Karl F. Freed
- his complete list of publications.
PUBLICATIONS of Karl Freed
Book:
"Renormalization Group Theory of Macromolecules." K. F. Freed, Wiley Interscience, New York, (1987).
1. Exact Solutions for Many-Level Multiple-Resonance Problems. K.F. Freed, J. Chem. Phys. 43, 1113 (1965).
2. Considerations on the Rotation-Vibration of Triatomic Molecules. K.F. Freed and J.R. Lombardi, J. Chem. Phys. 45,
591 (1966).
3. On the Hyperfine Structure of InH and the Theory of the Hyperfine Structure of Molecules in Hund's Case
(C). K.F. Freed, J. Chem. Phys. 45, 1714 (1966).
4. Theory of the Hyperfine Structure of Molecules: Application to 3? States of Diatomic Molecules Intermediate
between Hund's Cases (a) and (b). K.F. Freed,
J. Chem. Phys. 45, 4214 (1966).
5. Valence Excited States of BeO. W.M. Huo, K.F. Freed and W. Klemperer, J. Chem.
Phys. 46, 3556 (1967).
6. On the N-Representability of Fermion Density Matrices. K.F. Freed, J. Chem. Phys. 47, 3907 (1967).
7. Many-Body Approach to Electron Correlation in Atoms and Molecules. K.F. Freed,
Phys. Rev. 173, 1 (1968).
8. Generalized Perturbation Theory and its Application to the Pro1.tron Correlation in Atoms and Molecules. K.F.
Freed, Phys. Rev. 173, 24 (1968).
9. Geometry and Barriers to Internal Rotation in Hartree-Fock Theory. K.F. Freed,
Chem. Phys. Letters, 2, 255 (1968).
10. Entropy of a Confined Polymer: I. S.F. Edwards and K.F. Freed, J. Phys. A. (London) 2, 145 (1969).
11. Radiative Decay of Polyatomic Molecules. K.F. Freed and J. Jortner, J. Chem. Phys. 50, 2916 (1969).
12. Force Constants in Hartree-Fock Theory. K.F. Freed, J. Chem. Phys. 52, 253 (1970).
13. Irreversible Electronic Relaxation in Polyatomic Molecules. K.F. Freed, J. Chem. Phys. 52, 1345 (1970).
14. Cross Linkage Problem of Polymers, I. The Method of Second Quantization Applied
to the Cross Linkage Problem of Polymers. S.F. Edwards and K.F. Freed, J. Phys. C. C: Solid St. Phys. 3, 739 (1970).
15. Cross Linkage Problem of Polymers, II. Dilute Cross Linked Systems of Polymers. S.F. Edwards and K.F. Freed,
J. Phys. C: Solid St. Phys. 3, 750 (1970).
16. Cross Linkage Problem of Polymers, III. Dense Cross Linked Systems of Polymers. S.F. Edwards and K.F. Freed,
J. Phys. C: Solid St. Phys. 3, 760 (1970).
17. Internal Rotation and the Breakdown of the Adiabatic Approximation: Many-Phonon Radiationless Transitions.
W.M. Gelbart, K.F. Freed and S.A. Rice, J. Chem. Phys.
52, 2460 (1970).
18. Many-Body Perturbation Theory and the Variational Pairs of Quantum Chemistry.
K.F. Freed, Chem. Phys. Letters, 4, 496 (1970).
19. Elastic Moduli of Systems with Statistical Constraints. S.F. Edwards and K.F. Freed, J. Phys. C: Solid St. Phys. 3,
L31 (1970).
20. A Cluster Theory of the Electronic Structure of Disordered Systems. K.F. Freed and M.H. Cohen, Natl. Bur. Std.
(U.S.) Spec. Publ. 323, 505 (1972).
21. On a Stochastic Theory of Vibrational Relaxation and Dissociation. W.M. Gelbart, S.A. Rice and K.F. Freed, J. Chem.
Phys. 52, 5718 (1970).
22. Multiphonon Processes in the Non-Radiative Decay of Large Molecules. K.F. Freed
and J. Jortner, J. Chem. Phys. 52, 6272 (1970).
23. Boltzmann Statistics and Radiationless Decay in Large Molecules: Optical Selection Studies. W.M. Gelbart, K.G.
Spears, K.F. Freed, J. Jortner and S.A. Rice, Chem. Phys. Letters, 6, 345 (1970).
24. A Cluster Theory of the Electronic Structure of Disordered Systems. K.F. Freed and M.H. Cohen, Phys. Rev. B3,
3400 (1971).
25. Wiener Integrals and Models of Stiff Polymer Chains. K.F. Freed, J. Chem. Phys. 54, 1453 (1971).
26. Self-Consistent Field Theories of the Polymer Excluded Volume Problem: I. Edwards' Functional Integral
Approach. K.F. Freed, J. Chem. Phys. 55, 3910 (1971).
27. Self-Consistent Field Theories of the Polymer Excluded Volume Problem: II. Reiss' Variational Approach. K.F.
Freed and P. Gillis, Chem. Phys. Letters, 8, 384 (1971).
28. Many-Body Theories of the Electronic Structure of Atoms and Molecules. K.F. Freed, Ann. Rev. Phys. Chem. 22,
313 (1971).
29. Functional Integrals and Polymer Statistics. K.F. Freed, Advan. Chem. Phys.
22, 1 (1972).
30. The Theory of Radiationless Processes in Polyatomic Molecules. K.F. Freed, Topics in Current Chemistry, 31,
105 (1972).
31. Electronic Structure of Disordered Materials: A review of Current Theoretical
Understanding. E.N. Economou, M.H. Cohen, K.F. Freed and E.S. Kirkpatrick, in
Amorphous and Liquid Semiconductors, ed. J. Tauc. (Plenum, New York, 1974) p. 101.
32. On the Born-Oppenheimer Separation and the Calculation of Nonradiative Transition Rates. K.F. Freed and W.M.
Gelbart, Chem. Phys. Lett, 10, 187 (1971).
33. Statistical Mechanics of Systems with Internal Constraints: Rubber Elasticity.
K.F. Freed, J. Chem. Phys. 55, 5588 (1971).
34. Random Matrix Theory and the Master Equation for Finite Systems. W.M. Gelbart,
S.A. Rice and K.F. Freed, J. Chem. Phys. 57, 4699 (1972).
35. A Self-Consistent Field Theory of Electron Localization in Disordered Systems:
The Anderson Transition. K.F. Freed, J. Phys. C. 4, L331 (1971).
36. Proceedings of IUPAP Conference on Statistical Mechanics. eds. S.A. Rice, K.F. Freed and J. Light (University of
Chicago Press, 1972).
37. Dependence of Radiationless Decay Rates in Polyatomic Molecules upon the Initially Selected Vibronic State:
General Theory and Applications. D.F. Heller, K.F. Freed and W.M. Gelbart, J. Chem. Phys. 56, 2309 (1972).
38. Path Integrals and Semiclassical Tunneling, Wavefunctions and Energies. K.F. Freed, J. Chem. Phys. 56, 692
(1972).
39. A Derivation of the Exact Pi-Electron Hamiltonian. K.F. Freed, Chem. Phys. Letts. 13, 181 (1972).
40. Electron Localization in Disordered Systems. K.F. Freed, Phys. Rev. B. 5, 4802 (1972).
41. Energy Dependence of Nonradiative Decay Rates in Polyatomic Molecules. D.F. Heller and K.F. Freed, Int. J.
Quantum Chem. S6, 267 (1972).
42. Towards an Ab Initio Determination of All the Parameters Which Appear in Semi- empirical Quantum Chemical
Theories. K.F. Freed, Chem. Phys. Lett. 15, 331 (1972).
43. Properties of Localized States in Disordered Materials. K.F. Freed in Computational Methods for Large Molecules
and Localized States in Solids, eds. F. Herman, A.D. McLean and R.K. Nesbet (Plenum, New York, 1973).
44. Intramolecular Perturbation and the Quenching of Luminescence in Small Molecules. W.M. Gelbart and K.F.
Freed, Chem. Phys. Letts. 18, 470 (1973).
45. Completely Ab Initio Justification of Purely Semi-Empirical Theories. K.F. Freed, in
Energy, Structure and Reactivity, edited by Darwin W. Smith and Walter B. McRae, (Wiley, New York 1973), p. 374.
46. Many-Body Green's Functions and Atomic and Molecular Electronic Structure. F.S.M. Tsui and K.F. Freed, in
Energy Structure and Reactivity, edited by Darwin W. Smith and Walter B. McRae, (Wiley, New York 1973), p. 210.
47. Theoretical Foundations of Purely Semi-Empirical Quantum Chemistry. K.F. Freed,
J. Chem. Phys. 60, 1765 (1974).
48. Many-Body Theory in Quantum Chemistry. K.F. Freed, in Energy, Structure and Reactivity, ed. by Darwin W.
Smith and Walter B. McRae, (Wiley, New York, 1974),
p. 238.
49. Pressure Dependence of Electronic Relaxation: A Stochastic Model. K.F. Freed and D.F. Heller, J. Chem. Phys.
61, 3942 (1974).
50. Self Consistent Field Theory of Polymer Excluded Volume. K.F. Freed and H.P. Gillis, Polymer Preprints, 14, 226
(1973).
51. Comments on Semi-Classical Methods. K.F. Freed, Disc. Faraday Soc. 55, 68 (1973).
52. The Role of Accepting Modes in the Theory of Nonradiative Transitions. D.F. Heller, K.F. Freed and W.M.
Gelbart, Chem. Phys. Lett. 23, 56 (1973).
53. Theoretical Foundations of Purely Semi-Empirical Quantum Chemistry. II. Molecular Properties. K.F. Freed,
Chem. Phys. 3, 463 (1974).
54. Theoretical Foundations of Purely Semi-Empirical Quantum Chemistry. III. Repulsion Integrals, Chem. Phys. Lett.
24, 275 (1974).
55. Path Integrals and Optical Potentials for Elastic and Inelastic Scattering, Chem. Phys. 10, 393 (1975).
56. Open-Shell Generalized Perturbation Theory. K.F. Freed, Chem. Phys. 4, 80 (1974).
57. Ab Initio Calculations of the Pi Electron Hamiltonian: Singlet-Triplet Splittings.
S. Iwata and K.F. Freed, Chem. Phys. Lett. 28, 176 (1974).
58. The Theory of the Dynamical Viscosity of Polymer Solutions. S.F. Edwards and
K.F. Freed, J. Chem. Phys. 61, 1189 (1974).
59. Self-Consistent Solutions for the Self-Avoiding Walk. H.P. Gillis and K.F. Freed,
J. Phys. A. 7, L116 (1974).
60. Ab Initio Evaluation of Correlation Contributions to the True Pi-Electron Hamiltonian: Ethylene. S. Iwata and K.F.
Freed, J. Chem. Phys. 61, 1500 (1974).
61. Relationship Between One-Electron Green's Function and Quantum Chemical Theories. F.S.M. Tsui and K.F. Freed,
Chem. Phys. 5, 337 (1974).
62. Viscosity of Polymer Solutions. S.F. Edwards and K.F. Freed, Polymer Preprints
15, 120 (1974).
63. Polymer Viscosity in Concentrated Solutions. K.F. Freed and S.F. Edwards, J. Chem. Phys. 61, 3626 (1974).
64. Quantum Theory of Photodissociation of Polyatomic Molecules: Application to
HCN. Y.B. Band and K.F. Freed, Chem. Phys. Lett. 28, 328 (1974).
65. Nonradiative Decay Processes in Benzene. M.G. Prais, D.F. Heller and K.F. Freed, Chem. Phys. 6, 331 (1974).
66. Theoretical Basis for Semiempirical Pseudopotentials. K.F. Freed, Chem. Phys.
Letts. 29, 143 (1974).
67. Exactly Solvable Model for Nonradiative Decay with Variable Coupling Strength.
K. Morokuma and K.F. Freed, J. Chem. Phys. 61, 4342 (1974).
68. Dissociation Processes of Polyatomic Molecules. Y.B. Band and K.F. Freed, J.
Chem. Phys. 63, 3382 (1975).
69. Comparison Between Equations of Motion and Green's Function Methods for the
Particle-Hole Response Function. F.S.M. Tsui and K.F. Freed, Chem. Phys. Letts.
32, 345 (1975).
70. A Semiclassical Limit of Multichannel Scattering. J.R. Laing and K.F. Freed,
Phys. Rev. Letts. 34, 849 (1975).
71. Nuclear Coordinate Dependence of Electronic Matrix Elements for Radiationless
Transitions. K.F. Freed and S.H. Lin, Chem. Phys. 11, 409 (1975).
72. Response Function Theory of Electron Correlation. F.S.M. Tsui and K.F. Freed,
Chem. Phys. 14, 27 (1976).
73. Huggins Coefficient for the Viscosity of Polymer Solutions. K.F. Freed and
S.F. Edwards, J. Chem. Phys. 62, 4032 (1975).
74. A Theory for Time Resolved Emission Spectra. G.R. Fleming, O.L.J. Gijzeman,
K.F. Freed and S.H. Lin, J.C.S. Faraday II, 71, 773 (1975).
75. Screening Regimes for the Viscosity of Concentrated Polymer Solutions. K.F. Freed and S.F. Edwards, J.C.S.
Faraday Trans. II, 71, 2025 (1975).
76. Self-Consistent Field Theories of the Polymer Excluded Volume Problem III: A
Self-Consistent Solution. H.P. Gillis and K.F. Freed, J. Chem. Phys. 63, 852 (1975).
77. Configurational and Interstitial Relaxation Processes. K.F. Freed and K.F. Fong,
J. Chem. Phys. 63, 2890 (1975).
78. Energy Dependence of Electronic Relaxation Processes in Polyatomic Molecules.
K.F. Freed, Topics in Applied Physics, 15, 23 (1976).
79. Solution of Large Configuration Mixing Matrices Arising in Partitioning Technique and Applications to the
Generalized Eigenvalue Problem. S. Iwata and K.F. Freed, Chem. Phys. 11, 433 (1975).
80. Theoretical Basis for Semiempirical Theories. K.F. Freed in Modern Theoretical Chemistry 7, 201 (1977).
81. Large Isotope Effects in Photodissociation of Polyatomic Molecules. Y.B. Band
and K.F. Freed, J. Chem. Phys. 63, 4479 (1975).
82. Renormalization Group and Critical Localization. A. Nitzan, K.F. Freed and M.H. Cohen, Phys. Rev. B 15, 4476
(1977).
83. Enhancement of Quantum Interference Effects. A. Villaeys and K.F. Freed, Chem.
Phys. 13, 271 (1976).
84. Electronic Relaxation Processes in Benzene and Related Molecules. K.F. Freed,
J. Luminesc. 12/13, 339 (1976).
85. Theory of Collision Induced Induced Intersystem Crossing. II. Application to
Glyoxal. K.F. Freed, Chem. Phys. Lett. 37, 47 (1976).
86. Theory of Collision Induced Intersystem Crossing. K.F. Freed, J. Chem. Phys. 64, 1604 (1976).
87. Stochastic Model for Triplet Yields. K.H. Fung and K.F. Freed, Chem. Phys. 14, 13 (1976).
88. Distribution of Vibrational Populations of CO Electronic States Produced in CO2 Photodissociation. Y.B.
Band and K.F. Freed, J. Chem. Phys. 64, 4329 (1976).
89. Analysis of Exact Valence Shell Hamiltonian: Nonclassical Terms and Molecular
Based Parameters. S. Iwata and K.F. Freed, Chem. Phys. Lett. 38, 425 (1976).
90. Polymer Dynamics and the Hydrodynamics of Polymer Solutions. K.F. Freed in Progress in Liquid Physics,
ed. C.A. Croxton (Wiley Interscience London, 1978)
p. 343.
91. Concentration Dependence of the Translational Friction Coefficient for Polymer
Solutions. K.F. Freed, J. Chem. Phys. 65, 4103 (1976).
92. Excluded Volume Effect on Polymer Dynamics in Concentrated Solutions. K.F.
Freed, J. Chem. Phys. 64, 5126 (1976).
93. Excluded Volume Effect on Quasi-Elastic Neutron Scattering from Concentrated
Polymer Solutions. K.F. Freed, S.F. Edwards and M. Warner, J. Chem. Phys. 64,
5132 (1976).
94. Nonclassical Terms in the True Effective Valence Shell Hamiltonian: A Second Quantized Formalism. S. Iwata and
K.F. Freed, J. Chem. Phys. 65, 1071 (1976); 66, 1765 (1977).
95. Hydrodynamic Theory for Vibrational Relaxation in Liquids. H. Metiu, D.W. Oxtoby and K.F. Freed, Phys. Rev. A
15, 361 (1977).
96. Energy Distribution in Selected Fragment Vibrations in Dissociation Processes
in Polyatomic Molecules. Y.B. Band and K.F. Freed, J. Chem. Phys. 67, 1462 (1977).
97. Intramolecular Vibrational Relaxation: Electronic Relaxation as a Probe. K.F. Freed, Chem. Phys. Letts. 42, 600
(1976).
98. A Semiclassical Magnus Approximation to Coupled Space-Time-Dependent Scattering Equations. J.R. Laing and
K.F. Freed, Chem. Phys. 19, 91 (1977).
99. Rotational Distributions in Photodissociation: Application to ICN. M.D. Morse,
K.F. Freed and Y.B. Band, Chem. Phys. Letts. 44, 125 (1976).
100. Microscopic Theory of Polymer Internal Viscosity: Mode Coupling Approximation
for the Rouse Model. S.A. Adelman and K.F. Freed, J. Chem. Phys. 67, 1380 (1977).
101. Critical Analysis of Equations-of-Motion-Green's Function Methods: Ionization Potentials of N2. M.F. Herman, D.L.
Yeager and K.F. Freed, Chem. Phys. Lett. 46, 1 (1977).
102. Product Energy Distributions in the Dissociation of Polyatomic Molecules. K.F. Freed and Y.B. Band, Excited
States 3, 109 (1978).
103. Huggins Coefficient for Polymer Solutions with Excluded Volume. M. Muthukumar
and K.F. Freed, Macromolecules, 10, 899 (1977).
104. A Wavefunction Approach to Equations of Motion-Green's Function Methods. K.F. Freed and D.L. Yeager, Chem.
Phys. 22, 401 (1977).
105. Analysis of Third Order Contributions to Equations of Motion-Green's Function
Excitation Energies: Application to N2. D.L. Yeager and K.F. Freed, Chem. Phys.
22, 415 (1977).
106. Comments on Photodissociation and Effective Hamiltonian Theories. K.F. Freed,
Disc. Faraday Society 62, 144, 313 (1977).
107. Bulk Viscosity of Polymer Solutions. H. Metiu and K.F. Freed, J. Chem. Phys.
67, 3303 (1977).
108. Analytical Representation for Single Vibronic Level Decay Rates. M. Pagitsas
and K.F. Freed, Chem. Phys. 23, 387 (1977).
109. Rotational Mechanism for Vibrational Relaxation in Rigid Media. K.F. Freed
and M. Metiu, Chem. Phys. Letts. 48, 262 (1977).
110. Rotational Mechanism for Vibrational Relaxation in Rigid Media II. Interaction
Potentials. K.F. Freed, D.L. Yeager and H. Metiu, Chem. Phys. Letts. 49, 19 (1977).
111. Radiationless Transitions in Molecules. K.F. Freed, Acc. Chem. Res. 11, 74 (1977).
112. Vibronic Coupling and Spin Sublevel Decay Rates. K.F. Freed, N. Kanamaru and
E.C. Lim, J. Chem. Phys. 67, 2844 (1977).
113. Comparison of Semiclassical Treatments for Evaluating Franck-Condon Transition
Amplitudes for Molecular Dissociation. Y.B. Band, M.D. Morse and K.F. Freed,
J. Chem. Phys. 68, 2702 (1978).
114. Photodissociation: Isotope Effects and Comparisons between Theory and Experiment. M.D. Morse, K.F. Freed and
Y.B. Band, Chem. Phys. Letts. 49, 399 (1977).
115. Design of Natural Collision Coordinates to Describe Dissociation of Polyatomic Molecules. Y.B. Band and
K.F. Freed, J. Chem. Phys. 68, 1292 (1978).
116. Self-Consistent Field Theories of the Polymer Excluded Volume Problem. IV. The Linear Polymer. M. K. Kosmas
and K.F. Freed, J. Chem. Phys. 68, 4878 (1978).
117. Analysis of Third Order Contributions to Equations of Motion-Green's Function's
Ionization Potentials: Application to N2. M.F. Herman, D.L. Yeager and K.F. Freed, Chem. Phys. 29, 77 (1977)
118. Franck-Condon Theory of Reactive Scattering. K.H. Fung and K.F. Freed. Chem. Phys. 30, 249 (1978).
119. Mean Field Theory of the Hydrodynamics of Concentrated Polymer Solutions. K.F. Freed and H. Metiu, J. Chem.
Phys. 68, 4604 (1978).
120. Theory of Correlation Measurements of Resonance Light Scattering. A.A. Villaeys and K.F. Freed, Chem. Phys.
Letts. 54, 275 (1978).
121. On the Stokes Problem for a Suspension of Spheres at Finite Concentrations. K.F. Freed and M. Muthukumar, J.
Chem. Phys. 68, 2088 (1978).
122. Quantum Dynamics of a Molecule (Atom) in a Coherent Radiation Field. K.F. Freed and A.A. Villaeys, J. Chem.
Phys. 70, 3071 (1979).
123. Shake-up Peak Positions and Intensities by Many-Body Theory Methods. M.F. Herman, K.F. Freed and D.L. Yeager,
Chem. Phys. 32, 437 (1978).
124. Exponents for Electrical Conductivity in Disordered Materials. K.F. Freed, J. Phys.
C. 12, L17 (1979).
125. Theory of Concentration Dependence of Polymer Relaxation Times in Dilute Solutions. M. Muthukumar and K.F.
Freed, Macromolecules, 11, 843 (1978).
126. On Scaling Theories of Polymer Solutions. M.K. Kosmas and K.F. Freed, J. Chem.
Phys. 69, 3647 (1978).
127. Critical Exponents from Scaling with Neglect of Cut-Offs. K.F. Freed and M.K. Kosmas, Phys. Rev. B. 20,
215 (1979).
128. Collision Dynamics of Collision Induced Intersystem Crossing Processes. K.F. Freed and C. Tric, Chem. Phys. 33,
249 (1978).
129. Dynamics and Hydrodynamics of Suspensions of Translational-Rotation Brownian
Particles at Finite Concentrations. K.F. Freed and M. Muthukumar, J. Chem. Phys.
69, 2657 (1978).
130. Exactly Soluble Model for High Frequency Viscoelastic Behavior of Polymer Solutions. R.S. Adler and K.F. Freed,
Macromolecules, 1, 1058 (1978).
131. Ab Initio Calculation of the Effective Valence Shell Hamiltonian of Carbon: Simultaneous Treatment of Neutral and
Ion States. D.L. Yeager, H. Sun, K.F. Freed
and M.F. Herman, Chem. Phys. Lett. 57, 490 (1978).
132. Coherence Transfer Processes in Vibrational Relaxation of Polyatomic Molecules
in Condensed Media. K.F. Freed and A.A. Villaeys, Chem. Phys. 39, 51 (1979).
133. Rotational Distributions from Photodissociations. I. Linear Triatomic Molecules. M.D. Morse, K.F. Freed and Y.B.
Band, J. Chem. Phys. 70, 3604 (1979).
134. Rotational Distributions from Photodissociations. II. Results for ICN + hv-> I + CN(X2?+). M.D. Morse,
K.F. Freed and Y.B. Band, J. Chem. Phys. 70, 3620 (1979).
135. Viscosity of Random Coil Polymers with Nonzero Thickness. M. Muthukumar and
K.F. Freed, Chem. Phys. Lett. 58, 628 (1978).
136. Analysis of Approximations and Errors in Equations of Motion Method Calculations. M.F. Herman and K.F. Freed,
Chem. Phys. 36, 383 (1979).
137. On Dynamical Scaling Theories of Individual Polymers in Solution. R.S. Adler
and K.F. Freed, J. Chem. Phys. 70, 3119 (1979).
138. On the Stokes Problem for a Suspension of Spheres at Nonzero Concentration. II. Calculations for Effective
Medium Theory. M. Muthukumar and K.F. Freed, J. Chem. Phys. 70, 5875 (1979).
139. On Rotational Effects in Radiationless Processes in Polyatomic Molecules. F. A. Novak, S.A. Rice, M.D. Morse and
K.F. Freed, in Radiationless Transitions, ed. S.H. Lin (Academic Press, New York, 1980) p. 135.
140. Polymers as Self-Avoiding Walks. K.F. Freed, Ann. Prob. 9, 537 (1981).
141. Generalized Perturbation Theory of Effective Valence Shell Hamiltonians. M.G. Sheppard, K.F. Freed, M.F.
Herman and D.L. Yeager, Chem. Phys. Letts. 61, 577 (1979).
142. State-to-State Photochemical Reaction Dynamics in Polyatomic Molecules. K.F. Freed, M.D. Morse and Y.B. Band,
Faraday Disc. 67, 297, 133, 231, 350 (1979).
143. Collisional Effects on Electronic Relaxation. K.F. Freed, Adv. Chem. Phys. 42, 207 (1980).
144. Polymer Dynamics Including Side Group Motion: Free Draining Limit. R.S. Adler
and K.F. Freed, J. Chem. Phys. 72, 2032 (1980).
145. Critical Test of Equations of Motion-Green's Function Methods I: Theory of Higher Order Terms. M.F. Herman, K.F.
Freed and D.L. Yeager, J. Chem. Phys. 72, 602 (1980).
146. Critical Test of Equations of Motion-Green's Function Methods II: Comparison
with Configuration Interaction Results. M.F. Herman, K.F. Freed, D.L. Yeager and
B. Liu, J. Chem. Phys. 72, 611 (1980).
147. Ab Initio Calculation of One-Center Integrals of Semiempirical Theories of Valence.
K.F. Freed and H. Sun, Israel J. Chem. 19, 99 (1980).
148. Fragment Angular Distributions from Photodissociation of Triatomic Molecules,
Y.B. Band, M.D. Morse and K.F. Freed, Chem. Phys. Letts. 77, 294 (1979).
149. Critical Comparison Between Equation of Motion-Green's Function Methods and
Configuration Interaction Methods: Analysis of Methods and Applications. K.F. Freed, M.F. Herman and D.L.
Yeager, Phys. Scripta. 21, 242 (1980).
150. On Dynamic Scaling Theories of Polymer Solutions at Nonzero Concentrations.
R.S. Adler and K.F. Freed, J. Chem. Phys. 72, 4186 (1980).
151. Ab Initio Effective Valence Shell Hamiltonian for the Neutral and Ionic Valence States of N, O F, Si, P and S. H. Sun,
K.F. Freed, M.F. Herman and D.L. Yeager, J. Chem. Phys. 72, 4158 (1980).
152. One Center Integrals of the Exact Effective Valence Shell Hamiltonian: Empirical Analysis for Atoms. D.L. Yeager,
M.G. Sheppard and K.F. Freed, J. Am. Chem. Soc. 102, 1270 (1980).
153. Cluster Expansion for Concentration Dependence of Self Friction Coefficients for Suspensions of Interacting
Spheres. M. Muthukumar and K.F. Freed, J. Chem. Phys. 78, 497 (1983).
154. Cluster Expansion for Concentration Dependence of Cooperative Friction Coefficients or Suspensions of Interacting
Spheres. M. Muthukumar and K.F. Freed, J. Chem. Phys. 78, 511 (1983).
155. Theory of Photophysical Properties of Symmetric Chlorophyll Hydrated Dimers.
K.F. Freed, J. Am. Chem. Soc. 102, 3130 (1980).
156. Collision Induced Intersystem Crossing. K.F. Freed, Adv. Chem. Phys. 47, Part
II, 291 (1981).
157. Cluster Theory for Concentration Dependence of Shear Viscosity for Suspensions of Interacting Spheres I. K.F.
Freed and M. Muthukumar, J. Chem. Phys. 76, 6186 (1982).
158. Cluster Theory for Concentration Dependence of Shear Viscosity for Suspensions of Interacting Spheres II.
Calculations of Huggins Coefficient. M. Muthukumar and
K.F. Freed, J. Chem. Phys. 76, 6195 (1982).
159. Intensity Correlation Function for Resonant Weak Light Field Scattered by a Many Particle System. The
Bunched and Antibunched Components. A.A. Villaeys and
K.F. Freed, J. Phys. B13, 2729 (1980).
160. A Scaling Analysis of Theories of the Viscoelastic Properties of Entangled Polymer Systems. K.F. Freed,
Macromolecules, 13, 623 (1980).
161. Energetics of Photodissociation of Polyatomic Molecules. K.F. Freed, Springer Series in Solid State Sciences, 18,
246 (1980).
162. Half Collision Description of Final State Distributions of the Photodissociation of Polyatomic Molecules. Y.B.
Band, K.F. Freed and D.J. Kouri, J. Chem. Phys. 74, 4380 (1981).
163. Rotational and Angular Distributions from Photodissociations. III. Effects of
Dynamic Axis Switching in Linear Triatomic Molecules. M.D. Morse and K.F. Freed,
J. Chem. Phys. 74, 4395 (1981).
164. A Study of the Rotational State Dependence of Predissociation of Polyatomic
Molecules: The Case of ClO2. S. Michielsen, A.J. Merer, S.A. Rice, F.A. Novak,
K.F. Freed and Y. Hamada, J. Chem. Phys. 74, 3089 (1981).
165. Ab Initio Effective Valence Hamiltonian Description of Electron Correlation for
the Neutral Ion Valence States of Transition Metal Atoms. Y.S. Lee, H. Sun, M.G. Sheppard and K.F. Freed, J.
Chem. Phys. 73, 1472 (1980).
166. A One-Dimensional Microscopic Model for Thermal Desorption of an Atom I.
Applications to the Case of Weak Binding. S. Efrima, K.F. Freed, C. Jedrzejek and
H. Metiu, Chem. Phys. Letts. 74, 43 (1980).
167. Conformation Space Renormalization of Polymers. I. Single Chain Equilibrium
Properties Using Wilson-type Renormalization. Y. Oono and K.F. Freed, J. Chem. Phys. 75, 993 (1981).
168. Conformation Space Renormalization of Polymers. II. Single Chain Dynamics Based
on Chain Diffusion Equation Model. Y. Oono and K.F. Freed, J. Chem. Phys. 75, 1009 (1981).
169. Rotational Distributions in Photodissociation: The Bent Triatomic Molecule. M.D. Morse and K.F. Freed, Chem.
Phys. Letts. 74, 49 (1980).
170. Analysis and Evaluation of Ionization Potentials, Electron Affinities, and Excitation Energies by the Equations of
Motion-Green's Function Method. M.F. Herman, K.F. Freed and D.L. Yeager, Adv. Chem. Phys. 48, 1 (1981).
171. Intramolecular Vibrational Energy Redistribution and the Time Evolution of Molecular Fluorescence. K.F. Freed
and A. Nitzan, J. Chem. Phys. 73, 4765 (1980).
172. Concentration Dependence of the Viscoelastic Properties of Polymer Solutions
and Suspensions. K.F. Freed, Ferroelectrics, 30, 277 (1980).
173. Ab Initio Calculation of the Effective Valence Shell Hamiltonian. M.G. Sheppard,
H. Sun and K.F. Freed, NRC Proceedings, 10, 144 (1981).
174. Application of Dimensional Regularization to Single Chain Polymer Static
Properties: Conformational Space Renormalization of Polymers III. Y. Oono,
T. Ohta and K.F. Freed, J. Chem. Phys. 74, 6458 (1981).
175. A One-Dimensional Model for the Rate of Thermal Desorption of an Atom. II. The Role of Multiphonon Processes.
C. Jedrzejek, S. Efrima, H. Metiu and K.F. Freed, Chem. Phys. Letts. 79, 227 (1981).
176. Ab Initio Third Order Effective Valence Shell Hamiltonian Calculations for First Row Diatomic Hydrides. H. Sun,
M.G. Sheppard and K.F. Freed, J. Chem. Phys. 74, 6842 (1981).
177. Theoretical Test of Nonequilibrium Experimental Method for Measuring Heat of
Adsorption. C. Jedrzejek, O.L.J. Gijzeman and K.F. Freed, Surf. Sci. 107, 43 (1981).
178. First Principles Test of Transferability Hypothesis of Semiempirical Theories using Correlated Ab Initio Effective
Valence Shell Hamiltonian Methods. H. Sun, M.G. Sheppard, K.F. Freed and M.F. Herman, Chem. Phys. Letts. 77, 555
(1981).
179. Dissociation of Diatomic Molecules into Atoms with Nonvanishing Electronic Angular Momentum. I. Physical
Motivation for Theory. Y.B. Band, K.F. Freed and
D.J. Kouri, Chem. Phys. Letts. 79, 233 (1981).
180. Dissociation of Diatomic Molecules into Atoms with Nonvanishing Electronic
Angular Momentum. II. Theory. Y.B. Band and K.F.Freed, Chem. Phys. Letts. 79, 238 (1981).
181. Concentration Dependence of the Hydrodynamics of Polymer Solutions and
Suspensions. K.F. Freed, Polymer Preprints, 22, 64 (1981).
182. Elastic Properties of a Polymer Chain with Excluded Volume: A Renormalization
Group Theory. Y. Oono, T. Ohta and K.F. Freed, Macromolecules, 14, 880 (1981).
183. Analysis of Ab Initio Effective Valence Shell Hamiltonian Calculations Using Third Order Quasi-Degenerate
Many-Body Perturbation Theory. M.G. Sheppard and K.F. Freed, J. Chem. Phys. 75, 4507 (1981).
184. Convergence Studies of the Effective Valence Shell Hamiltonian for Correlation Energies of the Fluorine
Atom and Its Ions Using Third Order Quasidegenerate Many- Body Perturbation Theory. M.G. Sheppard and K.F. Freed,
J. Chem. Phys. 75, 4525 (1981).
185. The Static Scattering Function for a Polymer Chain in a Good Solvent. T. Ohta,
Y. Oono and K.F. Freed, Macromolecules, 14, 1588 (1981).
186. Ab Initio Effective Valence Shell Hamiltonian Calculation of the Valence State Potential Curves of CH and
CH+. H. Sun and K.F. Freed, Chem. Phys. Letts. 78, 531 (1981).
187. A One-Dimensional Microscopic Quantum Mechanical Theory of a Light Enhanced
Desorption. C. Jedrzejek, K.F. Freed, S. Efrima and H. Metiu, Surf. Sci. 109, 191 (1981).
188. Conformation Space Renormalization of Polymers IV. Equilibrium Properties of the Simple Ring Polymer Using
Gell-Mann-Low Type Renormalization Group Theory.
M. Lipkin, Y. Oono and K.F. Freed, Macromolecules, 14, 1270 (1981).
189. Theoretical Analysis of Experimental Probes of Dynamics of Intramolecular
Vibrational Relaxation. K.F. Freed and A. Nitzan, in Energy Storage and Redistribution in Molecules, ed. J. Hinze
(Plenum, New York, 1983 ) p. 467.
190. Considerations on the Multiple Scattering Representation of the Concentration
Dependence of the Viscoelastic Properties of Polymer Systems. K.F. Freed and
A. Perico. Macromolecules, 14, 1290 (1981).
191. Third Order Quasidegenerate Many-Body Perturbation Theory Calculations for
Valence State Correlation Energies of the Nitrogen and Oxygen Atoms and their
Ions. M.G. Sheppard and K.F. Freed, Int. J. Quantum Chem. 15, 21 (1981).
192. Static Coherent Scattering Function for a Single Polymer Chain: Conformational
Space Renormalization of Polymers. V.T. Ohta, Y. Oono and K.F. Freed, Phys. Rev.
A. 25, 2801 (1982).
193. Application of Quasidegenerate Many-Body Perturbation Theory to the Calculation
of Molecular Excited State Negative Ion Feshbach Resonances. H. Sun and K.F. Freed, J. Chem. Phys. 76, 5051
(1982).
194. Extrapolation Solution for Conformal Characteristics of Random Copolymers. A. L. Kholodenko and K.F. Freed.
Macromolecules, 15, 899 (1982).
195. Effective Many-Body Interactions in Exact Valence Shell Hamiltonians. M.G. Sheppard and K.F. Freed, Chem. Phys.
Lett. 82, 235 (1981).
196. Cross-over Behavior Between Gaussian and Self-Avoiding Limits of a Single
Polymer Chain: Conformational Space Renormalization for Polymers VI. Y. Oono
and K.F. Freed, J. Phys. A. 15, 1931 (1982).
197. Green's Function Semiclassical Quantization of Nonclosed Quasiperiodic Classical Trajectories. R. Kosloff and
K.F. Freed, Chem. Phys. Lett. 84, 6301 (1981).
198. Time Resolved Spectroscopy: Wave Packet Formalism in the Coherent State
Representation. A.A. Villaeys and K.F. Freed, Chem. Phys. 72, 1 (1982).
199. Electron Correlation Effects on the Structure of all 4dn 4sm Valence States of Ti,
V, Cr and their Ions as Studied by Quasidegenerate Many-Body Perturbation Theory. Y.S. Lee and K.F. Freed, J.
Chem. Phys. 77, 1984 (1982).
200. Ab Initio Treatments of Quasidegenerate Many-Body Perturbation Theory within the Effective Valence Shell
Hamiltonian Formalism. K.F. Freed and M.G. Sheppard, J. Phys. Chem. 86, 2130 (1982).
201. Invariant Imbedding Solution of Driven (Inhomogeneous) and Homogeneous Schrödinger Equations. S.
Singer, K.F. Freed and Y.B. Band, J. Chem. Phys. 77, 1942 (1982).
202. Direct First Principles Derivation of the Universal Density Functional. K.F. Freed and M. Levy, J. Chem. Phys.
77, 396 (1982).
203. On the n-Dependence of the Reaction Rate for C++Cn -> C+n+1 in Interstellar Space. K.F. Freed, T. Oka and H.
Suzuki, Ap. J. 263, 718 (1982).
204. Concentration Dependence of Friction Coefficients for Polymer Chains in Solution. K.F. Freed, J. Chem. Phys.
78, 2051 (1983).
205. Multiple Scattering Theory Calculation of the Concentration Dependence of the
Tracer and Cooperative Friction Coefficients for Gaussian Polymer Chains. A. Perico and K.F. Freed, J. Chem.
Phys. 78, 2059 (1983).
206. Diffusion Controlled Processes Among Stationary Reactive Sinks: Effective Medium Approach. R.I. Cukier and
K.F. Freed, J. Chem. Phys. 78, 2573 (1983).
207. Quantum Mechanical Model of the Dynamics of Desorption Processes. K.F. Freed,
H. Metiu, E. Hood and C. Jedrzejek, in Proc. 15th Jerusalem Symposium, eds. J. Jortner and B. Pullman,
Intramolecular Dynamics (D. Reidel, ed. 1982), p. 447.
208. Rotational Distributions from Photodissociations. IV. The Bent Triatomic Molecule. M.D. Morse and K.F. Freed,
J. Chem. Phys. 78, 6045 (1983).
209. Angular Distributions from Photodissociation. V. The Bent Triatomic Molecule.
M.D. Morse, Y.B. Band and K.F. Freed, J. Chem. Phys. 78, 6066 (1983).
210. Nonadiabatic Semiclassical Scattering: Atom-Diatom Collisions in Self-Consistent Matrix Propagator
Formalism. M.F. Herman and K.F. Freed, J. Chem. Phys. 78, 6010 (1983).
211. Is There a Bridge between Ab Initio and Semiempirical Theories of Valence?
K.F. Freed, Accts. Chem. Res. 16, 137 (1983).
212. Quantum Theory of the Dynamics of Electron Stimulated Desorption. K.F. Freed,
Surf. Sci. 122, 317 (1982).
213. Electronic Angular Momentum Effects on Photodissociation: Fine Structure Cross- Sections and Angular
Distributions for NaH->Na (2P1/2,3/2)+H(2S1/2). S.J. Singer,
K.F. Freed and Y.B. Band, Chem. Phys. Lett. 91, 12 (1982).
214. Theory of Transient Line Narrowing Spectroscopy. A.A. Villaeys, G. Klein, K.F. Freed and S.H. Lin, J. Mol. Sci.
(Wuhan, China) 2, 31 (1982).
215. Renormalization Group Description of Polymer Excluded Volume. K.F. Freed and
A.L. Kholodenko, J. Stat. Phys. 30, 437 (1983).
216. Renormalization Group Treatment of Polymer Excluded Volume by 't Hooft-Veltman Type Dimensional
Regularization. A.L. Kholodenko and K.F. Freed, J. Chem. Phys. 78, 7390 (1983).
217. Renormalization Group Treatment of Excluded Volume Effects in a Polyelectrolyte Chain in the Weak Electrostatic
Coupling Limit. A.L. Kholodenko and K.F. Freed, J. Chem. Phys. 78, 7412 (1983).
218. Ab Initio Effective Valence Shell Hamiltonian Calculations of Li2 Potential Curves. T. Takada, M.G. Sheppard
and K.F. Freed, J. Chem. Phys. 79, 325 (1983).
219. Ab Initio Calculations of the Pi-Hamiltonian of Trans-Butadiene Including Electron Correlation. Y.S. Lee and
K.F. Freed, Chem. Phys. Lett. 94, 202 (1983).
220. Determination of Slater-Condon and Trees Parameters in Terms of the Exact Effective Valence Shell Hamiltonian.
J.J. Oleksik and K.F. Freed, J. Chem. Phys. 79, 1396 (1983).
221. Excluded Volume Effects in Polymers Attached to Surfaces: Chain Conformational Renormalization Group.
K.F. Freed, J. Chem. Phys. 79, 3121 (1983).
222. Direct Path Integral Treatment of the Polaron Problem. A.L. Kholodenko and
K.F. Freed, Phys. Rev. B 27, 4586 (1983).
223. Correlated Effective Valence Shell Hamiltonian for the First-Row Transition
Metal Atoms. Y.S. Lee and K.F. Freed, J. Chem. Phys. 79, 839 (1983).
224. Electronic Energy Partitioning in Photochemistry, S.J. Singer, K.F. Freed and
Y.B. Band, Laser Chem. 3, 57 (1983).
225. A One-Dimensional Model for Phonon-Induced Adsorption. S. Efrima, C. Jedrzejek, K.F. Freed, E. Hood and H.
Metiu, J. Chem. Phys. 79, 2436 (1983).
226. Excluded Volume in Star Polymers: A Chain Conformation Space Renormalization
Group. A. Miyake and K.F. Freed, Macromolecules, 16, 1228 (1983).
227. The Correlated Pi-Hamiltonian of Trans-butadiene as Calculated by the Ab Initio Effective Valence Shell Hamiltonian
Method: Comparison with Semiempirical Models. Y.S. Lee, K.F. Freed, H. Sun and D.L. Yeager, J. Chem. Phys. 79,
3865 (1983).
228. Role of Intramolecular Vibrational Relaxation on Electron Transfer Rates: Application to Pentaammineruthenium (III)
(Histidine-33)-Ferricytochrome c. K.F. Freed, Chem. Phys. Lett. 97, 489 (1983).
229. Incorporation of Excluded Volume into the Multiple Scattering Theory of the Concentration Dependence of Polymer
Dynamics. K.F. Freed, Macromolecules, 16, 1855 (1983).
230. Concentration and Excluded Volume Dependence of Coherent Scattering Functions
for Polymers: Chain Conformational Space Renormalization Group. K.F. Freed,
J. Chem. Phys. 79, 6357 (1983).
231. Theory of Diatomic Molecule Photodissociation: Electronic Angular Momentum
Influence on Fragment and Fluorescence Cross-Section. S.J. Singer, K.F. Freed
and Y.B. Band, J. Chem. Phys. 79, 6060 (1983).
232. Theta Point ("Tricritical") Region Behavior for a Polymer Chain: Transition to Collapse. A.L. Kholodenko
and K.F. Freed, J. Chem. Phys. 80, 900 (1984).
233. Ab Initio Determination of Bond Length Dependence of the Correlated Valence Shell Hamiltonian of CH:
Comparison with Semiempirical Theories. H. Sun and K.F. Freed, J. Chem. Phys. 80, 779 (1984).
234. Internal Chain Conformations of Star Polymers. A. Miyake and K.F. Freed, Macromolecules, 14, 678 (1984).
235. Tests of Using Large Valence Spaces in Quasidegenerate Many-Body Perturbation Theory: Calculations of O2
Potential Curves. T. Takada and K.F. Freed, J. Chem. Phys. 80, 3696 (1984).
236. Concentration Dependence of the Viscoelastic Properties of Polymer Solutions.K.F. Freed and A. Perico, Faraday
Symp. Chem. Soc. 18, 29, 204, 205, 207, 221, 239, 241 (1983).
237. Relationship Between Renormalization Group, Two-Parameter Theory and Blob Models of Polymer Excluded
Volume. J. Douglas and K.F. Freed, Macromolecules, 16, 1800 (1983).
238. Analysis of the True Parameters in Correlated Effective Valence Shell Hamiltonian of Li2 and Comparison with
Semiempirical Parameters. T. Takada and K.F. Freed,
J. Chem. Phys. 80, 3253 (1984).
239. Diffusion in Random Media as a Problem of Interacting Bose and Fermi Fields.
A.L. Kholodenko and K.F. Freed, J. Phys. A. 17, L55 (1984).
240. Low Energy Resonances in Photodissociation of CH+. S.J. Singer, K.F. Freed and
Y.B. Band, Chem. Phys. Lett. 105, 158 (1984).
241. Conformational Space Renormalization Group Theory of "Tricritical" (Theta Point) Exponents for a Polymer Chain.
A.L. Kholodenko and K.F. Freed, J. Phys. A 17, 191 (1984).
242. Dissociation of a Diatomic Molecule to Atomic Fine Structure States: Electronically Non-Adiabatic Effects on
Resonant Two-Photon Dissociation. S.J. Singer, K.F. Freed and Y.B. Band, J. Chem. Phys. 81, 3064 (1984).
243. Cross Sections and Angular Distributions for Individual Fragment Fine Structure Levels Produced in One- and Two-
Photon Photodissociation of NaH. S.J. Singer, K.F. Freed and Y.B. Band, J. Chem. Phys. 81, 3091 (1984).
244. Influence of Draining and Excluded Volume on the Translational Diffusion Coefficient of Flexible Polymers. J.F.
Douglas and K.F. Freed, Macromolecules, 17, 2354 (1984).
245. Dynamics in Non-entangled Concentrated Polymer Solutions: I The Full Dynamic Multiple Scattering Approach to
First Order in Concentration. A. Perico and K.F. Freed, J. Chem. Phys. 81, 1466 (1984).
246. Dynamics in Non-entangled Concentrated Polymer Solutions: II Model Calculations
to First Order in Concentration. A. Perico and K.F. Freed, J. Chem. Phys. 81, 1475 (1984).
247. Mechanism for Efficient Collision Induced Intramolecular Vibrational Relaxation: Comparisons with
Experiment. K.F. Freed, Chem. Phys. Lett. 106, 1 (1984).
248. The Penetration Function and Second Virial Coefficient for Linear and Regular
Star Polymers. J.F. Douglas and K.F. Freed, Macromolecules, 17, 1854 (1984).
249. Renormalization and the Two-Parameter Theory. J.F. Douglas and K.F. Freed,
Macromolecules, 17, 2344 (1984).
250. A One-Dimensional Model for Phonon-Induced Desorption: II. Numerical Analysis
of the Desorption of Noble Gas Atoms (Argon, Krypton and Xenon) from Tungsten
and Carbon Monoxide from Copper. E. Hood, C. Jedrzejek, K.F. Freed and H. Metiu,
J. Chem. Phys. 81, 3277 (1984).
251. Photodissociation of Diatomic Molecules to Open Shell Atoms. S.J. Singer, K. F. Freed and Y.B. Band, Adv. Chem.
Phys. 61, 1 (1985).
252. Coil-globule Transition: Comparison of Field Theoretic and Conformational Space Formulations. A.L.
Kholodenko and K.F. Freed, J. Phys. A 17, 2703 (1984).
253. Dynamics in Non-entangled Concentrated Polymer Solutions: III. Exact Calculations
of the Frequency Dependent Relaxation Times and Normal Mode Autocorrelation Functions to First Order in
Concentration. A. , V. Buscaglia and K.F. Freed,
J. Chem. Phys. 81, 6281 (1984).
254. Renormalization and the Two-Parameter Theory 2. Comparison with Experiment and Other Two-Parameter
Theories. J.F. Douglas and K.F. Freed, Macromolecules, 18,
201 (1985).
255. Photodissociation of Homonuclear Diatomics: Fine Structure Cross Sections for Na(X1?g+) Na(2S1/2)
+Na(2P1/2.3/2).W. S. Struve, S.J. Singer and K.F. Freed, Chem. Phys. Lett. 110, 112 (1984).
256. Polydispersity Corrections on Excluded Volume Dependence in Flexible Polymers.
J.F. Douglas and K.F. Freed, J. Phys. Chem. 88, 6613 (1984).
257. Quantum Theory of the Full Pressure Dependence of Collision Induced Intersystem Crossing. P.R. Harrowell
and K.F. Freed, J. Chem. Phys. 83, 6288 (1985).
258. Surface Interaction Exponents for Surface Susceptibility: Renormalization Group Crossover for ?1. A.M.
Nemirovsky and K.F. Freed, Phys. Rev. B 31, 3161 (1985).
259. New Lattice Model for Interacting, Avoiding Polymers with Controlled Length Distribution. K.F. Freed, J.
Phys. A 18, 871 (1985).
260. Radiative and Nonradiative Decay Rates of Molecules Adsorbed on Clusters of Small Dielectric Particles. N.
Liver, A. Nitzan and K.F. Freed, J. Chem. Phys. 82, 3831 (1985).
261. Polymer Excluded Volume and the Renormalization Group. K.F. Freed, Accts. Chem. Res. 18, 38 (1985).
262. Test of Transferability in the Exact Effective Valence Shell Hamiltonian of Quasidegenerate Many-Body
Perturbation Theory: O+2 Calculation from O2 Effective Hamiltonian. J.J. Oleksik, T. Takada and K.F. Freed, Chem. Phys.
Letts. 113, 249 (1985).
263. Quantum Mechanical Theory of Isotope Effect on Thermally Activated Hydrogen Migration on W(110). K.F.
Freed, J. Chem. Phys. 82, 5264 (1985).
264. Polymer Migration in Newtonian Fluids. M.S. Jhon and K.F. Freed, J. Polym. Sci., Polym. Phys. Ed. 23, 955 (1985).
265. Renormalization Group Treatment of Finite Size Scaling with ?-Expansion. A.M. Nemirovsky and K.F. Freed,
J. Phys. A. 18, L319 (1985).
266. Non-Gaussian Corrections at the Theta Point: Comparison between Theory, Experiment and Numerical Simulations.
B.J. Cherayil, J.F. Douglas and K.F. Freed, Macromolecules, 18, 821 (1985).
267. Polymer Contraction Below the Theta-Point: A Renormalization Group Description. J.F. Douglas and K.F. Freed,
Macromolecules, 18, 2445 (1985).
268. Excluded Volume Effects for Polymers in Presence of Interacting Surfaces: Chain Conformation
Renormalization Group. A.M. Nemirovsky and K.F. Freed, J. Chem.
Phys. 83, 4166 (1985).
269. A Wiener Integral Model for Stiff Polymer Chains. M.G. Bawendi and K.F. Freed,
J. Chem. Phys. 83, 2491 (1985).
270. Surface Transition and ?-Expansion. A.M. Nemirovsky and K.F. Freed, J. Phys. A 18, 3275 (1985).
271. Polymers and Random Walks: Quantitative Description of Polymer Excluded Volume. K.F. Freed, J. Res. Natl. Bur.
Std. 90, 503 (1985).
272. Influence of Draining and Excluded Volume on the Intrinsic Viscosity of Flexible Polymers. S.-Q. Wang, J.F.
Douglas and K.F. Freed, Macromolecules, 18, 2464 (1985).
273. Effect of Residual Interactions on Polymer Properties near the Theta Point. B.J. Cherayil, J.F. Douglas and
K.F. Freed, J. Chem. Phys. 83, 5293 (1985).
274. Renormalization Group Treatment of Excluded Volume Effects in a Polyelectrolyte Chain in the Weak Coupling
Limit. II. Decomposition of Interactions and Calculation of Properties. M.G. Bawendi and K.F. Freed, J. Chem.
Phys. 84, 449 (1986).
275. Polymers in Two-Dimensions: A Renormalization Group Description. J.F. Douglas, B.J. Cherayil and K.F. Freed,
Macromolecules, 18, 2455 (1985).
276. Excluded Volume and Concentration Dependence of Hydrodynamics of Polymer Solutions. K.F. Freed, J.F.
Douglas, S.Q. Wang and A. Perico, AIP Confr. Proc. 137, 165 (1985).
277. Finite Size Scaling Close to the Critical Point: Renormalization Group and ï- Expansion. A.M. Nemirovsky and
K.F. Freed, J. Phys. A 19, 591 (1986).
278. On Contributions from Non-Born-Oppenheimer Corrections to the Calculation of
Large Distance Electron Transfer Rates. J. Chem. Phys. 84, 2108 (1986).
279. Orientation, Alignment and Hyperfine Effects on the Dissociation of Diatomic Molecules to Open Shell Atoms. Y.B.
Band, K.F. Freed and S.J. Singer, J. Chem.
Phys. 84, 3762 (1986), 86, 1650 (1987).
280. Nonradiative Decay and Mode Mixing in Benzene. A.A. Villaeys and K.F. Freed,
Chem. Phys. Lett. 123, 515 (1986).
281. Polymer-Polymer and Polymer-Surface Excluded Volume Effects in Flexible Polymers Attached to an Interface:
Comparison of Renormalization Group Calculations with Monte Carlo and Direct Enumeration Data. J.F. Douglas,
A.M. Nemirovsky and K.F. Freed, Macromolecules, 19, 2041 (1986).
282. Surface and Finite Size Effects in Critical Phenomena. A.M. Nemirovsky and K.F. Freed, Nucl. Phys. B 270, [FS16]
423 (1986).
283. A Lattice Model for Self-Avoiding Polymers with Controlled Length Distributions.
II. Corrections to Flory-Huggins Mean Field. M.G. Bawendi, K.F. Freed and U. Mohanty, J. Chem. Phys. 84,
7036 (1986).
284. Renormalization Group Treatment of the Hydrodynamics of Polymer Chains in the Rigid Body Approximation. K.F.
Freed, S.W. Wang and J.F. Douglas, in "Hydrodynamic Behavior and Interacting Particle Systems", ed. G.
Papanicolaou (Springer, New York, 1987), p. 57.
285. Spectroscopy of Low Energy Nonadiabatic Resonances in Photodissociation to Open Shell Atoms: CH+ a Model
System. C.J. Williams and K.F. Freed, Chem. Phys. Lett. 127, 360 (1986).
286. Test of a Multi-reference Many-Body Perturbation Theory for the Description of Electron Correlation in Four
Valence Electron States of Transition Metal Atoms.
Y.S. Lee, H. Sun, K.F. Freed and S.A. Hagstrom, Bull. Korean Chem. Soc. 7, 262 (1986).
287. Tunneling in Surface Diffusion. A. Auerbach, K.F. Freed and R. Gomer, in Tunneling, eds, J. Jortner and B. Pullman
(Reidel, New York, 1986) p.281.
288. Quadratic Spatial Anisotropy Model with Singularities: Comparison between Exact Solution and
Renormalization Group for Crossover Dependence. S.-Q. Wang and K.F. Freed, J. Phys. A 19, L637 (1986).
289. Interaction of a Polymer Chain with an Asymmetric Liquid-Liquid Interface. Z.-G. Wang, A.M. Nemirovsky and
K.F. Freed, J. Chem. Phys. 85, 3068 (1986).
290. Dynamics and Spectroscopy of Near Threshold Nonadiabatic Resonances in Photodissociation to Open Shell
Atoms: CH+ a Model System. C.J. Williams and
K.F. Freed, J. Chem. Phys. 85, 2699 (1986).
291. Statistical Mechanics of the Packing of Rods on a Lattice: Cluster Expansion for Systematic Corrections to
Mean Field. M.G. Bawendi and K.F. Freed, J. Chem. Phys. 85, 3007 (1986).
292. Nonadiabatic Effects on the Photodissociation of Diatomic Molecules to Open Shell Atoms: Resonances,
Polarizations and Angular Distributions for the CH+ Model System. C.J. Williams, K.F. Freed, S.J. Singer and Y.B.
Band, Faraday Disc. 82, 51 (1986).
293. Test of a Renormalization Group Crossover Dependence: Comparison with Exact Solution for a Polymer
Attached to a Penetrable Interacting Hypersurface. J.F. Douglas, S.-Q. Wang and K.F. Freed, Macromolecules, 19, 2207
(1986).
294. Corrections to Preaveraging Approximation within the Kirkwood-Riseman Model for Flexible Polymers:
Calculations to Second Order in ï with Both Hydrodynamic and Excluded Volume Interactions. S.-Q. Wang, J.F. Douglas
and K.F. Freed, J. Chem. Phys. 85, 3674 (1986).
295. Nonadiabatic Effects on Oxygen Atom Fine Structure Populations in the Predissociation of the A2?+ State of OH. S.
Lee, C.J. Williams and K.F. Freed, Chem. Phys. Lett. 130, 271 (1986).
296. Renormalization Group Study of Rouse-Zimm Model of Polymer Dynamics through Second Order in ?. S.-Q. Wang
and K.F. Freed, J. Chem. Phys. 85, 6210 (1986).
297. Osmotic Pressure of Star and Ring Polymers in Semidilute Solution. B.J. Cherayil, M.G. Bawendi and A. Miyake,
Macromolecules, 19, 2770 (1986).
298. Two Coupled Semi-infinite Systems Near Criticality. A.M. Nemirovsky, Z.-G. Wang and K.F. Freed, Phys. Rev.
B34, 7886 (1986).
299. Flexible Polymers with Excluded Volume at a Penetrable Interacting Surface. J.F. Douglas, S.W. Wang and
K.F. Freed, Macromolecules, 20, 543 (1987).
300. Anomalous Isotope Dependence of Hydrogen Diffusion Rates on Tungsten (110) Surfaces: Implications for
Lattice-Hydrogen Interactions. A. Auerbach, K.F. Freed and R. Gomer, J. Chem. Phys. 86, 2356 (1987).
301. Electronic Structure and Bond Length Dependence of the Effective Valence Shell Hamiltonian of S2 as Studied
by Quasidegenerate Many-Body Perturbation Theory.
X.-C. Wang and K.F. Freed, J. Chem. Phys. 86, 2899 (1987).
302. Lifetimes of Degenerate Benzene 1B2u Levels Split by Vibrational Angular Momentum. R.L. Rosman, A.A. Villaeys,
K.F. Freed and S.A. Rice, J. Chem. Phys. 86, 2576 (1987).
303. Renormalization Group Theory of Rouse-Zimm Model of Polymer Dynamics to Second Order in ?. II. Dynamic
Intrinsic Viscosity of Gaussian Chains. S.Q. Wang and K.F. Freed, J. Chem. Phys. 86, 3021 (1987).
304. A Lattice Model for Self and Mutually Avoiding Semi-Flexible Polymer Chains.
M.G. Bawendi and K.F. Freed, J. Chem. Phys. 86, 3720 (1987).
305. Statistical Mechanics. K. F. Freed, Encyclopedia of Polymer Science and Technology (Wiley, New York, 1989),
Vol. 15, p.584.
306. Polymers with Excluded Volume in Various Geometries. Z.-G. Wang, A.M. Nemirovsky and K.F. Freed, J.
Chem. Phys. 86, 4266 (1987).
307. Block Copolymers and Polymer Mixtures in Dilute Solution: General Crossover Analysis and Comparison
with Monte Carlo Calculations. J.F. Douglas and K.F. Freed, J. Chem. Phys. 86, 4280 (1987).
308. Change of a Flexible Polymer's Free Energy due to Excluded Volume, Molecular Architecture and the Presence of
Boundaries. B.J. Cherayil, J.F. Douglas and K.F. Freed, Macromolecules, 20, 1345 (1987).
309. Dynamic Multiple Scattering Theory of the Huggins Coefficient for Discrete Gaussian Chains. I. Formal Derivation
of the Full Frequency Dependence. A. Perico and K.F. Freed, J. Chem. Phys. 86, 5830 (1987).
310. Dynamic Multiple Scattering Theory of the Huggins Coefficient for Discrete Gaussian Chains. II. Numerical
Computations of the Frequency Dependence and Steady State Limit. A. Perico, R. LaFerla and K.F. Freed, J. Chem.
Phys. 86, 5842 (1987).
311. Three-dimensional Analytic Quantum Mechanical Theory for Triatomic Photo- dissociation. Role of Angle
Dependent Dissociative Surfaces on Rotational and Angular Distributions in the Rotational Infinite Order Sudden Limit.
H. Grinberg, J. Chem. Phys. 86, 5456 (1987).
312. Semidilute Polymer Solutions in the Theta Domain - A Renormalization Group Study. B.J. Cherayil, A.L.
Kholodenko and K.F. Freed, J. Chem. Phys. 86, 7204 (1987).
313. Influence of Variable Draining and Excluded Volume on the Hydrodynamic Radius within Kirkwood-Riseman Model:
Dynamical Renormalization Group Description to Order ?2. S.Q. Wang, J.F. Douglas and K.F. Freed, J. Chem. Phys.
87, 1346 (1987).
314. Influence of Molecular Geometry on Valence Space for Quasidegenerate Many-Body Perturbation Theory. M.R.
Hoffmann, X.C. Wang and K.F. Freed, Chem. Phys. Lett. 136, 392 (1987).
315. Effect of Residual Interactions on Polymer Properties Near the Theta Point II. Higher Moments and Comparison with
Monte Carlo Calculations. B.J. Cherayil, J.F. Douglas and K.F. Freed, J. Chem. Phys. 87, 3089 (1987).
316. Crossover Renormalization Group Approach to Semi-infinite Inhomogeneous Critical Behavior. A.M.
Nemirovsky, Z.G. Wang and K.F. Freed, Phys. Rev. B36, 3755 (1987).
317. Nonadiabatic Effects on the Photodissociation of Diatomic Molecules to Open-Shell Atoms. Y.B. Band, K.F.
Freed, S.J. Singer and C.J. Williams, J. Phys. Chem. 91, 5402 (1987).
318. Multichannel Quantum Theory for Propagation of Second Order Transition Amplitudes. S.J. Singer, S. Lee, K.F.
Freed and Y.B. Band, J. Chem. Phys. 87, 4762 (1987).
319. A Lattice Field Theory for Polymer Systems with Nearest Neighbor Interaction Energies. M.G. Bawendi,
K.F. Freed and U. Mohanty, J. Chem. Phys. 87, 5534 (1987).
320. Theoretical Analysis of Nonadiabatic Effects on the Predissociation of the A2?+ State of OH. S. Lee and K.F. Freed,
J. Chem. Phys. 87, 5772 (1987).
321. Low Energy Atomic Scattering of Ground State C+(2P) Ions by Atomic Hydrogen: Role of Nonadiabatic Couplings
and Resonances in Elastic and Inelastic Processes. C.J. Williams and K.F. Freed, J. Phys. B20, 5737 (1987).
322. Lattice Models of Polymer Solutions. Monomers Occupying Several Lattice Sites. A.M. Nemirovsky, M.G. Bawendi
and K.F. Freed, J. Chem. Phys. 87, 7272 (1987).
323. Langevin Dynamics of Rouse Chains Under Flow. S.Q. Wang and K.F. Freed, J. Chem. Phys. 88, 3944 (1988).
324. Comparison between Borel Resummation and Renormalization Group Descriptions of Polymer Expansion. K.F.
Freed and J.F. Douglas, J. Chem. Phys. 88, 2764 (1988).
325. Theory of the Molecular Origins of the Entropic Portion of the Flory ? Parameter
for Polymer Blends. K.F. Freed and A.I. Pesci, J. Chem. Phys. 87, 7342 (1987).
326. Molecular Properties by Ab Initio Quasidegenerate Many-Body Perturbation Theory Effective Hamiltonian
Method. Dipole and Transition Moments of CH and CH+. H. Sun and K.F. Freed, J. Chem. Phys. 88, 2659; 89, 5355 (1988).
327. Systematic Corrections to Flory-Huggins Theory: Polymer-Solvent-Void Systems and Binary Blend-Void Systems.
M.G. Bawendi and K.F. Freed, J. Chem. Phys. 88, 2741 (1988).
328. Semidilute Good Solvent Solutions of Polymers in a Box: Finite Size Corrections
by Renormalization Group Methods. B.J. Cherayil and K.F. Freed, J. Chem. Phys. 88, 7851 (1988).
329. Role of Free Volume on the Interpretation of Effective Blend Interaction Parameters from Neutron Scattering
Data. K.F. Freed, J. Chem. Phys. 88, 5871 (1988).
330. On the Equivalence of the Kirkwood Diffusion Equation to the Coupled Polymer Solvent Langevin Dynamics. S.-Q.
Wang and K.F. Freed, J. Phys. A21, 2453 (1988).
331. Partial Draining and Universality of Dilute Solution Polymer Dynamics: Comparison of Theory and Experiment.
K.F. Freed, S.-Q. Wang, J. Roovers and J.F. Douglas, Macromolecules, 21, 2219 (1988).
332. The Flory ‡ Parameter and Phase Separation in Semidilute Polymer Mixtures-A Renormalization Group
Study. B.J. Cherayil and K.F. Freed, Macromolecules, 21,
3204 (1988).
333. Effective Medium Theory for Elastic Matrix Composites Containing Dispersed Particulates. M.S. Jhon, R.J.
Metz and K.F. Freed, J. Stat. Phys. 52, 1325 (1988).
334. Dipole Moment Function of OH by Ab Initio Effective Valence Shell Hamiltonian Method. H. Sun, Y.S. Lee
and K.F. Freed, Chem. Phys. Lett. 150, 529 (1988).
335. Apparent Radius of Gyration of Diblock Copolymers. W.E. McMullen, K. F. Freed and B.J. Cherayil,
Macromolecules, 22, 1853 (1989).
336. Lattice Models of Polymer Fluids: Monomers Occupying Several Lattice Sites. II. Interaction Energies. A.I.
Pesci and K.F. Freed, J. Chem. Phys. 90, 2003 (1989).
337. Lattice Theory of Polymer Blends and Liquid Mixtures: Beyond the Flory-Huggins Approximation. A.I. Pesci
and K.F. Freed, J. Chem. Phys. 90, 2017 (1989).
338. Dilute Polymer Solutions in Flow: Derivation of Hydrodynamic Equations. Y. Rabin, S.-Q. Wang, and K.F. Freed,
Macromolecules, 22, 2420 (1989).
339. Lattice Theories of Polymeric Fluids. K.F. Freed and M.G. Bawendi, J. Phys. Chem. 93, 2194 (1989).
340. Cluster Expansion for Flexible Polymeric Fluids in which Bonding Constraints are Treated as Perturbations.
K.F. Freed, J. Chem. Phys. 90, 3261 (1989).
341. Close Coupled Calculations of Resonance Widths Observed in Photodissociation Spectra of CH+. K. F. Freed, P.J.
Sarre, C.J. Whitham and and C.J. Williams, J. Chem. Phys. 90, 6070 (1989).
342. A Theoretical Analysis of Raman Scattering from Predissociating Molecules. S.Lee and K.F. Freed, J. Chem. Phys. 90,
7030 (1989).
343. Tests and Applications of Complete Model Space Quasidegenerate Many-Body Perturbation Theory for
Molecules. K.F. Freed, Lect. Notes in Chem. 52, 1 (1989).
344. Incorporating Advantages of Time-dependent Dynamics in Time-independent Collision Methods: Early Asymptotic
Analysis. S.J. Singer, S. Lee and K.F. Freed, J. Chem. Phys. 91, 240 (1989).
345. Computation of the Crosslink Dependence of the Effective Flory Interaction Parameter ? for Polymer Networks.
K.F. Freed and A.I. Pesci, Macromolecules, 22, 4048 (1989).
346. Quasidegenerate Many-Body Perturbation Theory of CH2. X.-C. Wang and K.F. Freed, J. Chem. Phys. 91, 1142
(1989); Erratum, J. Chem. Phys. 94, 5253 (1991).
347. Ab Initio Test of the Pairwise Additive Assumption of Semiempirical Electronic Structure: Spectator Model
of Correlation Contributions. X.-C. Wang and K.F. Freed,
J. Chem. Phys. 91, 1151 (1989).
348. Static Structure Factors of Compressible Polymer Blends and Diblock Copolymer Melts. W.E. McMullen and K.F.
Freed, Macromolecules, 23, 255 (1990).
349. Comparison of Complete Model Space Quasidegenerate Many-Body Perturbation Theory for LiH with
Multireference Coupled Cluster Method. X.-C. Wang and K.F. Freed, J. Chem. Phys. 91, 3002 (1989).
350. Theory of Diatomic Photodissociation to Atomic Hyperfine Structure States. S. Lee, C.J. Williams and K.F. Freed,
Israel J. Chem. 30, 3 (1990).
351. Leading Concentration Correction to Polymer Dynamic Self-Structure Factor. A. Perico, R. La Ferla and K.F. Freed,
J. Chem. Phys. 91, 4387 (1989).
352. Phase Equilibria of Lattice Polymer and Solvent: Tests of Theories Against Simulation. W.G. Madden, A.I. Pesci and
K.F. Freed, Macromolecules, 23, 1181 (1990).
353. Influence of Blend Compressibility on Extrapolated Zero Angle Coherent Scattering and Spinodal: Limitations of
RPA Analysis. J. Dudowicz and K.F. Freed, Macromolecules, 23, 1519 (1990).
354. A Density Functional Theory of Polymer Phase Transitions. W.E. McMullen and K.F. Freed, J. Chem. Phys. 92,
1413 (1990).
355. Characterization of Branching Architecture through "Universal" Ratios of Polymer Solution Properties. J.F. Douglas,
J. Roovers and K.F. Freed, Macromolecules, 23, 4168 (1990).
356. Three-Dimensional Analytic Quantum Theory for Triatomic Photodissociations: II. Angle Dependent Dissociative
Surfaces and Rotational Infinite Order Sudden Approximation for Bent Triatomics. H. Grinberg, K.F. Freed and C.J.
Williams, J. Chem. Phys. 92, 7283 (1990).
357. Polypeptide Dynamics: Experimental Tests of an Optimized Rouse-Zimm Type Model. Y. Hu, J.M. MacInnis, B.J.
Cherayil, G.R. Fleming, K.F. Freed and A. Perico, J. Chem. Phys. 93, 822 (1990).
358. Role of Molecular Structure on the Thermodynamic Properties of Melts, Blends, and Concentrated Polymer
Solutions: Comparison of Monte Carlo Simulations with Cluster Theory for the Lattice Model. J. Dudowicz, K.F. Freed
and W.G. Madden, Macromolecules, 23, 4803 (1990).
359. Effects of Surface, Wedge, Corner, and Mixed Boundary Conditions on the Local Critical Behavior. Z.G.
Wang, A.M. Nemirovsky, K.F. Freed and K.R. Myers, J. Phys. A23, 2575 (1990).
360. Light Scattering with Evanescent Waves: Intermolecular Interference and the Structure Factor for an Ideal Flexible
Chain at an Interacting Interface. J. Gao,
K.F. Freed and S.A. Rice, J. Chem. Phys. 93, 2785 (1990).
361. Static Structure Factors of Compressible Polymer Blends and Diblock Copolymer Melts: II. Constraints on Density
Fluctuations. H. Tang and K.F. Freed, Macromolecules, 24, 958 (1991).
362. Dipole Moments, Transition Moments, Oscillator Strengths, Radiative Lifetimes, and Overtone Intensities for CH
and CH+ as Computed by Quasidegenerate Many-Body Perturbation Theory. A.W. Kanzler, H. Sun and K.F. Freed, Int. J.
Quantum Chem. 39, 269 (1991).
363. Free Energy Functional Expansion for Inhomogeneous Polymer Blends. H. Tang and
K.F. Freed, J. Chem. Phys. 94, 1572 (1991).
364. A Density Functional Theory of Polymer Phase Transitions and Interfaces II: Block Copolymers. W.E.
McMullen and K.F. Freed, J. Chem. Phys. 93, 9130 (1990).
365. Dynamics Studies of Tryptophan and Single Tryptophan Containing Peptides: Simulations and an Analytical Model.
Y. Hu, J.M. MacInnis, B.J. Cherayil, G.R. Fleming, K.F. Freed and A. Perico, SPIE Proceedings, Vol. II, ed. J.R.
Lukowicz (1990) p. 425.
366. Effective Valence Shell Hamiltonian and Potential Curves of the Oxygen Molecule from Quasidegenerate Many-body
Perturbation Theory. A.W. Kanzler and K.F. Freed, J. Chem. Phys. 94, 3778 (1991).
367. Interfacial Studies of Incompressible Binary Blends. H. Tang and K.F. Freed, J. Chem. Phys. 94, 6307 (1991).
368. Role of Monomer Structure and Compressibility on the Properties of Multicomponent Polymer Blends and
Solutions: I. Lattice Cluster Theory of Compressible Systems. J. Dudowicz and K.F. Freed, Macromolecules, 24, 5076
(1991).
369. Role of Monomer Structure and Compressibility on the Properties of Multicomponent Polymer Blends and
Solutions: II. Application to Binary Blends. J. Dudowicz, M.S. Freed and K.F. Freed, Macromolecules, 24, 5096 (1991).
370. Role of Monomer Structure and Compressibility on the Properties of Multicomponent Polymer Blends and
Solutions: III. Application to PS(D)/PVME Blends. J. Dudowicz and K.F. Freed, Macromolecules, 24, 5112 (1991).
371. Interference Effects in the Polarized Emission Spectrum of Methyl Iodide at 248 nm: Scattering through Two Coupled
Optically Bright Excited States. M.R. Wedlock, E. Jensen, L.J. Butler and K.F. Freed, J. Phys. Chem. 95, 8096 (1991).
372. Composition Dependent ? and Microphase Transitions of Diblock Copolymers. H. Tang and K.F. Freed, J.
Chem. Phys. 94, 7554 (1991).
373. Influence of Initial State Bend-stretch Couplings on Product Rotational Distributions of Bent Triatomic Molecules,
H. Grinberg, K. F. Freed, and C. J. Williams. Chem. Phys. Lett. 182, 297 (1991).
374 Role of Monomer Structure and Compressibility on the Properties of Multicomponent Polymer Blends and Solutions:
IV. High Molecular Weights, Temperature Dependences, and Phase Diagrams of Binary Polymer Blends. K. F. Freed
and J. Dudowicz, Theor. Chim. Acta. 82, 357 (1992).
375 Chain Stretching in Ordered Microphases of Diblock Copolymers. H. Tang and K. F. Freed, J. Chem. Phys. 95,
3012 (1991).
376 Conformations of a Polymer Boxed into a Corner: Role of Excluded Volume. K. Myers, A. M. Nemirovsky, and Z. G.
Wang, J. Chem. Phys. 95, 6112 (1991)
377 Quantum Calculations of the Polarized Emission Spectrum of Methyl Iodide: Importance of Interference Effects. M.
R. Wedlock and K. F. Freed, J. Chem. Phys. 95, 7275 (1991).
378 Theory of Long Time Peptide Dynamics: Test of Various Reduced Descriptions and Role of Internal Variables. Y. Hu,
G. R. Fleming, K. F. Freed, and A. Perico, Chem. Phys. 158, 395 (1991).
379 Ab Initio Study of the Trans-butadiene p-valence States Using Effective Valence Shell Hamiltonian Method, R. L.
Graham and K. F. Freed, J. Chem. Phys. 96, 1304 (1992).
380. Polarization Effects in Resonance Raman Scattering from Coupled Optically Bright States. R. A. Harris, M. R.
Wedlock, L. J. Butler, and K. F. Freed, J. Chem. Phys. 96, 2437 (1992).
381. The Algebra of Effective Hamiltonians and Operators: Exact Operators. V. Hurtubise and K. F. Freed, Adv. Chem.
Phys. 83, 465 (1993).
382. Correlation Lengths and Chain Sizes in PS/PVME Blends. Influence of Compressibility, Interactions, and Monomer
Structures. J. Dudowicz and K. F. Freed, J. Chem. Phys. 96, 1644 (1992).
383. Spin-Independent Three-Body Effective Valence Shell Operators: Application to Molecular Oxygen. A. W.
Kanzler, K. F. Freed, and M. G. Sheppard, Int. J. Quantum. Chem. 44, 643 (1992).
384. Thermodynamics of a Dense Self-avoiding Walk with Contact Interactions. A. M. Nemirovsky, J. Dudowicz, and K. F
Freed, J. Stat. Phys. 67, 395 (1992).
385. On Square Gradient Theories of Polymer Blend Interfaces. X. C. Zeng, D. W. Oxtoby, H. Tang, and K. F.
Freed, J. Chem. Phys. 96, 4816 (1992).
386. The Ab Initio Effective Dipole Operator of CH: Comparison with Semiempirical Methods. A. W. Kanzler, K.
F. Freed, and H. Sun, J. Chem. Phys. 96, 5245 (1992).
387. End-to-end Distance of a Single Self-interacting Self-avoiding Polymer Chain: d-1 Expansion. A. M.
Nemirovsky, K. F. Freed, T. Ishinabe, and J. F. Douglas, Phys. Lett. A 162, 469 (1992).
388. Dense Self-interacting Lattice Trees with Specified Topologies: From Light to Dense Branching. A. M.
Nemirovsky, J. Dudowicz, and K. F. Freed, Phys. Rev. A 45, 7111 (1992).
389. Marriage of Exact Enumeration and 1/d Expansion Methods: Lattice model of Dilute Polymers. A. M.
Nemirovsky, K. F. Freed, T. Ishinabe, and J. F. Douglas, J. Stat. Phys. 67, 1083 (1992).
390. Influence of Compressibility and Monomer Structure on Small Angle Neutron Scattering from Binary Polymer
Blends. J. Dudowicz and K. F. Freed, J. Chem. Phys. 96, 9147 (1992).
391. Immiscibility Induced Chain Stretching, Local Segregation, and Formation of Locally Ordered Domains in Diblock
Copolymers. H. Tang and K. F. Freed, J. Chem. Phys. 96, 8621 (1992).
392. On the Large Entropic Contribution to the Effective Interaction Parameter of Polystyrene-poly(methylmethacrylate)
Diblock Copolymers. K. F. Freed and J. Dudowicz, J. Chem. Phys. 97, 2105 (1992).
393. Surface Tension of Dilute Polymer Solutions I. A Renormalization Group Approach. K. R. Myers, A. M.
Nemirovsky, and K. F. Freed, J. Chem. Phys. 97, 2790 (1992).
394. Surface Properties of Semi-infinite Diblock Copolymer Melts. H. Tang and K. F. Freed, J. Chem. Phys. 97, 4496
(1992).
395. Positional Time Correlation Function for One-dimensional Systems with Barrier Crossing: Memory Function
Corrections to the Optimized Rouse-Zimm Approximation. A. Perico, R. Pratolongo, K. F. Freed, R. W. Pastor, and A.
Szabo, J. Chem. Phys. 98, 564 (1993)
396. Relation of Effective Interaction Parameters for Binary Blends and Diblock Copolymers: Lattice Cluster Theory
Predictions and Comparison with Experiments. J. Dudowicz and K. F. Freed, Macromolecules 26, 213 (1993).
397. Surface Tension of Dilute Polymer Solutions. II. The Second Virial Coefficient. K. R. Myers and K. F. Freed, J.
Chem. Phys. 98, 2437 (1993).
398. Dissociation Dynamics of CH=SH at 222, 248, and 193nm: An Analog for Probing Nonadiabatic Bimolecular
Reactions. E. Jensen, J. S. Keller, G. C. G. Waschewsky, J. E. Stevens, R. L. Graham, K. F. Freed, and L. J. Butler, J.
Chem. Phys. 98, 2882 (1993).
399. Hypercubic Lattice SAW exponents ? and ?: 3.99 Dimensions Revisited. J. F. Douglas, T. Ishinabe, A. M.
Nemirovsky, and K. F. Freed, J. Phys. A 26, 1835 (1993).
400. Photodissociation of Molecules Physisorbed on Inert Crystalline Surfaces. G. Hose and K. F. Freed, J. Chem. Phys. 98,
7527 (1993).
401. Effect of Various Frictional Models on Long Time Peptide Dynamics. K. Kostov, K. F. Freed, and A. Perico,
Biopolymers 33, 1423 (1993).
402. Osmotic Pressure of Linear, Star and Ring Polymers in Semi-Dilute Solution. G. Merkle, W. Burchard, P. Lutz, K. F.
Freed, and J. Gao, Macromolecules 26, 2736 (1993).
403. Interfacial Behavior of Compressible Polymer Blends. M. Lifschitz and K. F. Freed, J. Chem. Phys. 98, 8994
(1993).
404. Packing Entropy of Extended, Hard, Rigid Objects on a Lattice. W. Li, K. F. Freed, and A. M. Nemirovsky, J. Chem.
Phys. 98, 8469 (1993).
405. Lattice Cluster Theory for the Packing of Rods on a Lattice: Extension to Treat Anisotropic Orientational
distributions. S. E. Huston, A. M. Nemirovsky, and K. F. Freed, J. Chem. Phys. 99, 2149 (1993).
406. How Far Is Far from the Critical Point in Polymer Blends? Lattice Cluster Theory Computations for Structured
Monomer, Compressible Systems. J. Dudowicz, M. Lifschitz, K. F. Freed, and J. F. Douglas, J. Chem. Phys. 99, 4804
(1993).
407. The Algebra of Effective Hamiltonians and Operators: Truncated Operators and Computational Aspects. V.
Hurtubise and K. F. Freed, J. Chem. Phys. 99, 7946 (1993).
408. Test of Theory for Long Time Dynamics of Floppy Molecules in Solution Using Brownian Dynamics
Simulation of Octane. X. Y. Chang and K. F. Freed, J. Chem. Phys. 99, 8016 (1993).
409. Ab Initio Study of Cyclobutadiene Using the Effective Valence Shell Hamiltonian Method. C. H. Martin, R. L.
Graham., and K. F. Freed, J. Chem. Phys. 99, 7833 (1993).
410. Limits of Validity for Mean Field Description of Compressible Binary Polymer Blends. M. Lifschitz, J. Dudowicz, and
K. F. Freed, J. Chem. Phys. 100, 3957 (1994).
411. Lattice Cluster Theory of Compressible Diblock Copolymer Melts. J. Dudowicz and K. F. Freed, J. Chem. Phys. 100,
4653 (1994).
412. Towards a Molecular Theory of Polymer Blends. K. F. Freed and J. Dudowicz, Makromol. Chem., Macromol. Symp.
78, 29 (1994).
413. Examination of 1/d Expansion Method from Exact Enumeration-for a Self-interacting Self-avoiding Walk. T.
Ishinabe, J. F. Douglas, A. M. Nemirovsky, and K. F. Freed, J. Phys. A. 27, 1099 (1994).
414. Perturbative and Complete Model Space Linked Diagrammatic Expansions for the Canonical Effective Operator. V.
Hurtubise and K. F. Freed, J. Chem. Phys. 100, 4955 (1994).
415. Ab Initio Vertical Ionization Potentials of trans-butadiene and Cyclobutadiene Using the Effective Valence Shell
Hamiltonian Method. C. H. Martin, R. L. Graham and K. F. Freed, J. Phys. Chem. 98, 3467 (1994).
416. Towards a Molecular Theory for Modeling Long Time Polymer Dynamics. X. Y. Chang and K. F. Freed, Chem. Engr.
Sci. 49, 2821 (1994).
417. Ab Initio Computation of Semiempirical p-electron Methods I: Constrained, Transferable Valence Spaces in Hv
Calculations. C. H. Martin and K. F. Freed, J. Chem. Phys. 100, 7454 (1994).
418. Three-dimensional Analytic Infinite Order Sudden Quantum Theory for Triatomic Photodissociation:
Dependence on Initial Rotational and Vibrational State and on Thermal Averages for NOCl Dissociation on T1 (3A')
Surface. H. Grinberg, C. J. Williams, and K. F. Freed, J. Chem. Phys. 100, 9215 (1994).
419. Packing Rods on d-dimensional Lattices. From Direct Enumeration to Series Expansions. A. M. Nemirovsky, S. E.
Huston, R. L. Graham, and K. F. Freed, J. Chem. Phys. 101, 510 (1994).
420. Lattice Cluster Theory for Phase Behavior of Rectangular Mesogens. W. Li and K. F. Freed, J. Chem. Phys. 101,
519 (1994).
421. Torsional Time Correlation Function for One-dimensional Systems with Barrier Crossing: Periodic Potential.
A. Perico, R. Pratolongo, K. F. Freed, and A. Szabo, J. Chem. Phys. 101, 2554 (1994).
422. Ab Initio Computation of Semiempirical p-electron Methods II: Transferability of Hv Parameters between Ethylene,
Trans-butadiene, and Cyclobutadiene. C. H. Martin and K. F. Freed, J. Chem. Phys. 101, 4011 (1994).
423. Excited Potential Energy Surfaces of CH3SH from the Ab Initio Effective Valence Shell Hamiltonian Method. J. E.
Stevens, K. F. Freed, M. F. Arendt, and R. L. Graham, J. Chem. Phys. 101, 4832 (1994).
424. Ab Initio Computation of Semiempirical p-electron Methods. III. The Benzene Molecule, the Zero-
differential-overlap Approximation, and the Transferability of Parameters. C. H. Martin and K. F. Freed, J. Chem. Phys.
101, 5929 (1994).
425. Towards a Molecular Basis for Understanding the Behavior of Isotopic Polymer Blends: Lattice Cluster Theory
Computations for PSD/PSH Blends. J. Dudowicz, K. F. Freed, and M. Lifschitz, Macromolecules 27, 5387 (1994).
426. Molecular Modeling of Polymer Blends: Stabilization of Blends by Block Copolymers. K. F. Freed and J. Dudowicz,
Pure Appl. Chem. 67, 969 (1995).
427. Competition between Hydrodynamic Screening ("Draining") and Excluded Volume Interactions in an Isolated
Polymer Chain. J. F. Douglas and K. F. Freed, Macromolecules 27, 6088 (1994).
428. Polymer Melt Near a Solid Wall. P. K. Brazhnik, K. F. Freed, and H. Tang, J. Chem. Phys. 101, 9143 (1994).
429. Application of Complete Space Multi-reference Many-body Perturbation Theory to N2: Dependence on Reference
Space and H'. J. P. Finley and K. F. Freed, J. Chem. Phys. 102, 1306 (1995).
430. Ab Initio Computation of Semiempirical p-electron Methods. IV. True and Approximate Effective Hamiltonians
for Hexatriene and Related Conjugated Polyenes. C. H. Martin and K. F. Freed, J. Phys. Chem. 99, 2701 (1995).
431. Generalizations of Huggins-Guggenheim-Miller Type Theories to Describe the Architecture of Branched Lattice
Chains. K. W. Foreman and K. F. Freed, J. Chem. Phys. 102, 4663 (1995).
432. Modification of the Phase Stability of Polymer Blends by Diblock Copolymer Additives. J. Dudowicz, K. F. Freed,
and J. F. Douglas, Macromolecules 28, 2276 (1995).
433. Building a Bridge between Ab Initio and Semiempirical Theories of Molecular Electronic Structure. K. F. Freed, in
Structure and Dynamics of Atoms and Molecules: Conceptual Trends, Eds. J. L. Calais and E. Kryachko (Kluwer,
Netherlands, 1995).
434. Multiexponential Approximations to the Torsional Time Correlation Function for One- dimensional Systems with
Many Barriers. R. Pratolongo, A. Perico, K. F. Freed, and A. Szabo, J. Chem. Phys. 102, 4683 (1995).
435. Hyperbolic Tangent Variational Approximation for Interfacial Profiles of Binary Polymer Blends. M.
Lifschitz, K. F. Freed, and H. Tang, J. Chem. Phys. 103, 3767 (1995).
436. Interrelation between Density Functional and Self-consistent Field Formulations for Inhomogeneous Polymer
Systems. K. F. Freed, J. Chem. Phys. 103, 3230 (1995).
437. A Lattice Model Molecular Theory for the Properties of Polymer Blends. K. F. Freed and J. Dudowicz, Trends
Polym. Sci. 3, 248 (1995).
438. Application of Multireference Perturbation Methods to Potential Energy Surfaces by Optimal Partitioning of H:
Intruder States Avoidance and Convergence Enhancement. J. P. Finley, R. K. Chaudhuri, and K. F. Freed, J. Chem. Phys. 103,
4990 (1995).
439. Lattice Cluster Theory for Phase Behavior of Rectangular Mesogens II: Nearest Neighbor Interactions, Phase
Diagrams, and Competitive Nematic Orderings. W. Li and K. F. Freed, J. Chem. Phys. 103, 5693 (1995).
440. Pressure Dependence of Polymer Fluids: Application of the Lattice Cluster Theory. J. Dudowicz and K. F. Freed,
Macromolecules 28, 6625 (1995).
441. Extended Molecular Dynamics and Optimized Rouse-Zimm Model Studies of a Short Peptide: Various Friction
Approximations. Y. Hu, K. Kostov, A. Perico, S. Smithline, and K. F. Freed, J. Chem. Phys. 103, 9091 (1995).
442. Theory for Long Time Polymer and Protein Dynamics: Basis Functions and time Correlation Functions. W. H.
Tang, X.-Y. Chang, and K. F. Freed, J. Chem. Phys. 103, 9492 (1995).
443. Response to "Draining in Dilute Polymer Solutions and Renormalization." K. F. Freed and J. F. Douglas,
Macromolecules 28, 8460 (1995).
444. Influence of Short Chain Branching on Miscibility of Binary Polymer Blends: Application to Polyolefin Mixtures. K.
F. Freed and J. Dudowicz, Macromolecules 29, 625 (1996).
445. Theory for Long Time Polymer and Protein Dynamics: Tests for All-atom Models of Alkane Dynamics. X. Y. Chang
and K. F. Freed, J. Chem. Phys. 104, 3092 (1996).
446. Ab Initio Study of Cis-butadiene Valence and Rydberg States using the Effective Valence Shell Hamiltonian method.
S. Y. Lee and K. F. Freed, J. Chem. Phys. 104, 3260 (1996
).
447. The Concentration Dependent Cooperative Friction Coefficient of Dilute Polymer Solutions at the Theta Point. B. J.
Cherayil and K. F. Freed, J. Chem. Phys. 104, 5983 (1996).
448. Application of Graph Theory to the Statistical Thermodynamics of Lattice Polymers. I. Elements of Theory and
Test for Dimers. O. D. Brazhnik and K. F. Freed, J. Chem. Phys. 105, 837 (1996).
449. Convergence Behavior of Multireference Perturbation Theory: Forced Degeneracy and Optimized Partitioning
Applied to the Beryllium Atom. J. P. Finley, R. K. Chaudhuri, and K. F. Freed, Phys. Rev. A 54, 343 (1996).
450. Interfacial Behavior of Phase Separated Asymmetric Compressible Binary Polymer Blends. M. Lifschitz and K.
F. Freed, J. Chem. Phys. 105, 1633 (1996).
451. Ab Initio Computation of Semiempirical p-electron methods. V Geometry Dependence of p-electron integrals. C. H.
Martin and K. F. Freed, J. Chem. Phys. 105, 1437 (1996).
452. Extended Rotational Isomeric Model for Describing the Long Time Dynamics of Polymers. M. Guenza and K.
F. Freed, J. Chem. Phys. 105, 3823 (1996).
453. Global Three-dimensional Potential Energy Surfaces of H2S from the Ab Initio Effective Valence Shell Hamiltonian
Method. J. E. Stevens, R. K. Chaudhuri, and K. F. Freed, J. Chem. Phys. 105, 8754 (1996).
454. Molecular Origin of the Free Energy Dependence on the Monomer Sequence in Random Copolymer Systems. J.
Dudowicz and K. F. Freed, Macromolecules 29, 7826 (1996).
455. Analytic theory of Surface Segregation in Compressible Polymer Blends. K. F. Freed, J. Chem. Phys. 105, 10572
(1996).
456. Molecular Modeling of Phase Behavior of Polymer Blends. K. F. Freed and J. Dudowicz, Macrom. Symp. 112, 17
(1966).
457. Mode Coupling Theory for Calculating the Memory Functions of Flexible Chain Molecules. Influence on the
Long Time Dynamics of Oligioglycines. K. S. Kostov and K. F. Freed, J. Chem. Phys. 106, 771 (1997).
458. Influence of Monomer Structure and Interaction Asymmetries on the Miscibility and Interfacial Properties of
Polyolefin Blends. J. Dudowicz and K. F. Freed, Macromolecules 29, 8960 (1996).
459. Comparison of the Perturbative Convergence with Multireference M˜oller-Plesset, Epstein-Nesbet, Forced Degenerate
and Optimized Zeroth Order Partitionings: The Excited BeH2 Surface. R. K. Chaudhuri, J. P. Finley, and K. F. Freed,
J. Chem. Phys. 106, 4067 (1997).
460. Microscopic Parameters Influencing the Phase Separation in Compressible Binary Blends of Linear Semiflexible
Polymers. K. W. Foreman and K. F. Freed, J. Chem. Phys. 106, 7422 (1997).
461. Modification of Continuum Chain Model of Surface Interacting Polymers to Describe the Crossover Behavior
between Weak and Strong Adsorption. J. F. Douglas and K. F. Freed, Macromolecules 30, 1813 (1997).
462. Application of the Effective Valence Shell Hamiltonian Method to Accurate Estimation of Valence and Rydberg
States Oscillator Strengths and Excitation Energies for p Electron Systems. R. K. Chaudhuri, A. Mudholkar, K. F.
Freed, C. H. Martin, and H. Sun, J. Chem. Phys. 106, 9252 (1997).
463. Three-Dimensional Analytical Infinite Order Sudden Quantum Theory for Triatomic Indirect Photodissociation
Processes. H. Grinberg, K. F. Freed, and C. J. Williams, J. Chem. 107, 1836 (1997).
464. Three-dimensional Infinite Order Sudden Quantum Theory for Indirect Photodissociation Processes. Application to the
Photofragment Yield Spectrum of NOCl in the Region of the T1(13A'') ? S0(11A') Transition. Fragment Rotational
Distributions and Thermal Averages. H. Grinberg, K. F. Freed, and C. J. Williams, J. Chem. 107, 1849 (1997).
465. Energetically Driven Asymmetries in Random Copolymer Miscibilities and Their Pressure Dependence, J.
Dudowicz and K. F. Freed, Macromolecules 30, 5506 (1997).
466. Non-random Mixing in Polymer Blends: Implications for Phase Behavior. K. W. Foreman, K. F. Freed, and I
M. Ngola, J. Chem. Phys. 107, 4688 (1997).
467. Surface Segregation in Polymer Blends. K. F. Freed, Polymer Preprints (Am. Chem. Soc., Div. Polym. Mat. Sci
Engr.) 77, 638 (1997).
468. Comparison of High Order Perturbative Convergence of Multireference Perturbation Methods. Applicaion to Singlet
States of CH2. R. K. Chaudhuri and K. F. Freed, J. Chem. Phys. 107, 6699 (1997).
469. Influence of Stiffness, Monomer Structure, and Energetic Asymmetries on Polymer Blend Miscibilities: Applications
to Polyolefins, K. W. Foreman and K. F. Freed, Macromolecules 30, 7295 (1997).
470. Lattice Cluster Theory of Multicomponent Polymer Systems: Chain Semiflexibility and Specific Interactions. K. W.
Foreman and K. F. Freed, Adv. Chem. Phys. 103, 335 (1998).
471. Application of the Effective Valence Shell Hamiltonian Method to Accurate Estimation of Oscillator Strengths and
Excitation Energies of Mg-like Ions R. K. Chaudhuri, B.P. Das, and K. F. Freed, J. Chem. Phys. 108, 2556 (1998).
472. Molecular Mechanisms for Disparate Miscibilities of Poly(propylene) and Head-to- Head Poly(propylene) with
Other Polyolefins. K. F. Freed, J. Dudowicz, and K. W. Foreman, J. Chem. Phys. 108, 7881 (1998).
473. Theory for the Nonequilibrium Dynamics of Flexible Chain Molecules: Relaxation to Equilibrium of Pentadecane
from an All-trans Conformation. W. H. Tang, K. S. Kostov, and K. F. Freed, J. Chem. Phys. 108, 8736 (1998).
474. Mode Coupling Theory for Calculating the Memory Functions of Flexible Polymers. Local Dynamics of
Oligoglycines. K. S. Kostov and K. F. Freed, J. Chem. Phys. 108, 8277 (1998)
475. Dynamics of Linear and Branched Alkane Melts. Molecular Dynamics Test of Theory for Long Time Dynamics. K. S.
Kostov, K. F. Freed, E. B. Webb, III, M. Mondello, and G. S. Grest, J. Chem. Phys. 108, 9155 (1998).
476. Molecular Influences on Miscibility Patterns in Random Copolymer/Homopolymer Binary Blends. J. Dudowicz and K.
F. Freed, Macromolecules 31, 5096 (1998)
477. Modeling the Phase Behavior of Random Copolymer/homopolymer Polyolefin Blends. J. Dudowicz and K. F. Freed,
Polym. Mat. Sci. Eng. 79, 240 (1998).
478. Miscibility Patterns in Random Copolymer/homopolymer Mixtures. J. Dudowicz and K. F. Freed, Polym. Mat. Sci.
Eng. 79, 118 (1998).
479. Molecular Factors Governing Miscibility of Polymer Blends. K. F. Freed, J. Dudowicz, and K. W. Foreman, Polym.
Mat. Sci. Eng. 79, 68 (1998).
480. Molecular Modeling as an Aid to Controlling the Miscibility of Polymer Blends. K. F. Freed, J. Dudowicz, and K.
W. Foreman, Polym. Mat. Sci. Eng. 79, 238 (1998).
481. Lattice Cluster Theory for Pedestrians: The Incompressible Limit and the Miscibility of Polyolefin Blends. K. F. Freed
and J. Dudowicz, Macromolecules 31, 6681 (1998).
482. Long Time Dynamics of Met-enkephalin: Comparison of Theory with Brownian Dynamics Simulations. K. S. Kostov
and K. F. Freed, Biophys. J. 76, 149-163 (1999).
483. Evaluation of Analytic Molecular Orbital Derivatives and Gradients Using the Effective Valence Shell Hamiltonian
Method. R. K. Chaudhuri, J. E. Stevens, and K. F. Freed, J. Chem. Phys. 109, 9685 (1998).
484. Pragmatic Analysis for the Range of Validity of the Lattice Cluster Theory. K. F. Freed and J. Dudowicz, J. Chem.
Phys. 110, 1307-12 (1999).
485. Lattice Model of Living Polymerization. I: Basic thermodynamic Properties. J. Dudowicz, K. F. Freed, and J. F.
Douglas, J. Chem. Phys. 111, 7116-30 (1999).
486. Lattice Cluster Theory for Pedestrians: Models for Random Copolymer Blends. K. F. Freed and J. Dudowicz,
Macromol. Symp. 149, 11-16 (2000).
487. Molecular Factors Affecting the Miscibility Behavior of Cycloolefin Copolymers. C. Delfolie, L. C. Dickinson, K.
F. Freed, J. Dudowicz, and W. J. MacKnight, Macromolecules 32, 7781-9 (1999).
488. Lattice Model of Living Polymerization. 2: Interplay between Polymerization and Phase Stability. J. Dudowicz, K. F.
Freed, and J. F. Douglas, J. Chem. Phys. 112, 1002-10 (2000).
489. Thermodynamic Properties of Lattice Polymers: Monte Carlo Simulations and Mean Field Theories Theory. D
Buta, K. F. Freed, and I. Szleifer, J. Chem. Phys. 112, 6040-8 (2000).
490. Polymer Melts and Polymer Solutions Near Patterned Surfaces. C. Seok, K. F. Freed, and I. Szleifer, J. Chem.
Phys. 112, 6443-51 (2000).
491. Polymer Bends Near Patterned Surfaces. C. Seok, K. F. Freed, and I. Szleifer, J. Chem. Phys. 112, 6452-60 (2000).
492. Theoretical Studies on Excited States of a Phenolate Anion in the Environment of Photoactive Yellow Protein. Z. He,
C. H. Martin, R. Birge, and K. F. Freed, J. Phys. Chem. A 104, 2939-52 (2000).
493. Lattice Cluster Theory for Pedestrians: II. Random Copolymer Systems. J. Dudowicz and K. F. Freed, Macromolecules
33, 3467-77 (2000).
494. Determination of Conformational Energy Differences of Propynlidyne Isomers Using the Effective Valence Shell
Hamiltonian Method. R. K. Chaudhuri, S. Mazumder, and K. F. Freed, J. Chem. Phys. 112, 9301-9 (2000).
495. Lattice Model of Living Polymerization. III: Evidence for Particle Clustering from Phase Separation Properties and
"Rounding" of the Dynamical Clustering Transition. J. Dudowicz, K. F. Freed, and J. F. Douglas, J. Chem. Phys. 113,
434-46 (2000).
496. Explanation for the Unusual Phase Behavior of Polystyrene-b-Poly(n-alkyl methacrylate) Diblock Copolymers:
Specific Interactions. J. Dudowicz and K. F. Freed, Macromolecules 33, 5292-9 (2000).
497. Monte Carlo Test of the Lattice Cluster Theory: Thermodynamic Properties of Binary Polymer Blends. D. Buta, K. F.
Freed, and I. Szleifer, J. Chem. Phys. 114, 1424 (2001).
498. Explanation for the Inversion of an UCST Phase Diagram to a LCST Phase Diagram in Binary Polybutadiene Blends.
J. Dudowicz and K. F. Freed, Macromolecules 33, 9777 (2000).
499. The Improved Virtual Orbital-Complete Active Space Configuration Interaction Method, A "Packageable" Efficient
Ab Initio Many-body Method for Describing Electronically Excited States, D. M. Potts, C. M. Taylor, R. K.
Chaudhuri, and K. F. Freed, J. Chem. Phys. 114, 2592 (2001).
500. A Critical Comparison of Theoretical and Experimental Electronic Spectrum and Potential Energy Curves of HF
Molecule and Its Positive and Negative Ions. R. K. Chaudhuri, K. F. Freed, S. A. Abrash, and D. M. Potts, J. Mol .
Spectr.(THEOCHEM) 547, 83 (2001).
501. Lattice Cluster Theory for Copolymer Blends: General Theory in the Incompressible System, Long Chain Limit. J.
Dudowicz and K. F. Freed, Polish J. Chem. 75, 527 (2001).
502. Quantum Interference and Asymptotic Interactions in the Photodissociation of SH: Total Cross Section and Branching
Ratios. S. Lee, H. Sun., B. Kim, and K. F. Freed, J. Chem. Phys.114, 5537 (2001).
503. Small Angle Neutron Scattering Studies of Polybutadiene/Polystyrene Blends as a Function of Pressure and
Microstructure: Comparison of Experiment and Theory. H. Frielinghaus, D. Schwahn, J. Dudowicz, K. F. Freed, and
K. W. Foreman, J. Chem. Phys. 114, 5016 (2001).
504. Thermodynamic regulation of actin polymerization. P. S. Niranjan, J. G. Forbes, S. C. Greer, J. Dudowicz, K. F. Freed,
and J. F. Douglas, J. Chem. Phys. 114, 10573 (2001).
505. The Excited and Ion States of Allene. R. K. Chaudhuri, K. F. Freed, and D. M. Potts, ACS Symposium Volume "
Accurate description of low-lying electronic states and potential energy surfaces," Eds. M. R. Hoffmann, and K. Dyall
(in press).
506. Small Angle Neutron Scattering Studies of a Polytadiene/Polystyrene Blend with Small Additions of Ortho-di-chloro-
benzend in Varying Temperature and Pressure Fields. II: Phase Boundaries and Flory-Huggins Parameter. H.
Frielinghaus, D. Schwahn, L. Willner, and K. F. Freed, J. Chem. Phys. (in press).
507. Long Time Dynamics of Met-Enkephalin: Comparison of Explicit and Implicit Solvent Models. M. Y. Shen and K. F.
Freed, Biophys. J. (in press).
508. A Comparison of Self-assembly in Lattice and off-lattice Model Amphiphile solutions. D. Bedrov, G. D. Smith, K. F.
Freed, and J. Dudowicz, J. Chem. Phys. (in press).
509. Beyond Flory-Huggins Theory: New Classes of Blemd Miscibility Associated with Monomer Structural Asymmetry.
J. Dudowicz, K. F. Freed, and J. F. Douglas, Phys. Rev. Lett. (in press).
Last updated : Jan. 27, 2002 - 16:25
